ML 265 - Moligand™, ≥98% , Activator of pyruvate kinase M1/2, CAS No.1221186-53-3, Activator of pyruvate kinase M1/2

CAS: 1221186-53-3 Cat. No.: M333473 分子式: C17H16N4O2S2 分子量: 372.5
注文可能
グレード&純度 Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
Synonyms
[6-(3-Aminobenzyl)-4-methyl-5-oxo-5,6-dihydro-4H-thieno[2',3':4,5]pyrrolo[2,3-d]pyridazin-2-yl](methyl)sulfoniumolate|2-METHYLPYRIDINE [HSDB]|4-methyl morpholine|ML265|ML-265|6-(3-aminobenzyl)-4-methyl-2-(methylsulfinyl)-4,6-dihydro-5H-thieno[2',3':4,5]pyrrolo[2,3-d]pyridazin-5-one|TEPP46|TEPP-46|TEPP-46 (ML265, CID-44246499, NCGC00186528)|6-[(3-Aminophenyl)methyl]-2-(methanesulfinyl)-4-methyl-4,6-dihydro-5H-thieno[2',3':4,5]pyrrolo[2,3-d]pyridazin-5-one|10-[(3-aminophenyl)methyl]-7-methyl-4-methylsulfinyl-3-thia-7,10,11-triazatricyclo[6.4.0.0^{2,6]dodeca-1(8),2(6),4,11-tetraen-9-one|6-[(3-aMinophenyl)Methyl]-4,6-dihydro-4-Methyl-2-(Methylsulfinyl)-5H-Thieno[2',3':4,5]pyrrolo[2,3-d]|6-[(3-aminophenyl)methyl]-4,6-dihydro-4-methyl-2-(methylsulfinyl)-5h-thieno[2',3':4,5]pyrrolo[2,3-d]pyridazin-5-one|6-[(3-aminophenyl)methyl]-4-methyl-2-methylsulfinyl-5-thieno[3,4]pyrrolo[1,3-d]pyridazinone|10-[(3-aminophenyl)methyl]-7-methyl-4-methylsulfinyl-3-thia-7,10,11-triazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),4,11-tetraen-9-one|ML 265|6-[(3-aMinophenyl)Methyl]-4,6-dihydro-4-Methyl-2-(Methylsulfinyl)-5H-Thieno[2',3'
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
★
サイズ
USA
ドイツ (EU)*
価格
個数
5mg
M333473-5mg
3 在庫あり
—

$265.90

$398.90
保存 $133.00 (33.34%)
10mg
M333473-10mg
3 在庫あり
—

$398.90

$598.90
保存 $200.00 (33.39%)
25mg
M333473-25mg
2 在庫あり
—

$678.90

$1,018.90
保存 $340.00 (33.37%)
50mg
M333473-50mg
2 在庫あり
—

$1,153.90

$1,730.90
保存 $577.00 (33.34%)
100mg
M333473-100mg
2 在庫あり
—

$1,960.90

$2,941.90
保存 $981.00 (33.35%)
Enter a quantity for the sizes you want to add.

仕様

同義語
[6-(3-Aminobenzyl)-4-methyl-5-oxo-5,6-dihydro-4H-thieno[2',3':4,5]pyrrolo[2,3-d]pyridazin-2-yl](methyl)sulfoniumolate | 2-METHYLPYRIDINE [HSDB] | 4-methyl morpholine | ML265 | ML-265 | 6-(3-aminobenzyl)-4-methyl-2-(methylsulfinyl)-4,6-dihydro-5H-thieno[2',3':4,5]pyrrolo[2,3-d]pyridazin-5-one | TEPP46 | TEPP-46 | TEPP-46 (ML265, CID-442464 もっと見る
仕様と純度
Moligand™, ≥98%
保管条件
Store at -20°C
入荷
Ice chest + Ice pads
この製品は冷冷この冷このこの製品の運送が必要です。地上およびその他の経済サービスは利用できません。
等級
Moligand™
アクションタイプ
ACTIVATOR
作用メカニズム
Activator of pyruvate kinase M1/2
純度
≥98%
名前と識別子
パブケム・シド
パブケム・シド・ウル
https://pubchem.ncbi.nlm.nih.gov/substance/488200983
カノニカル・スマイル
CN1C2=C(C3=C1C(=O)N(N=C3)CC4=CC(=CC=C4)N)SC(=C2)S(=O)C
IUPAC Name
10-[(3-aminophenyl)methyl]-7-methyl-4-methylsulfinyl-3-thia-7,10,11-triazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),4,11-tetraen-9-one
InChIKey
ZWKJWVSEDISQIS-UHFFFAOYSA-N
INCHI
1S/C17H16N4O2S2/c1-20-13-7-14(25(2)23)24-16(13)12-8-19-21(17(22)15(12)20)9-10-4-3-5-11(18)6-10/h3-8H,9,18H2,1-2H3
異性体SMILES
CN1C2=C(C3=C1C(=O)N(N=C3)CC4=CC(=CC=C4)N)SC(=C2)S(=O)C
分子量
372.5
Reaxy-Rn
20138466
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=20138466&ln=

詳細データ

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
分類Thienopyrroles
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentThienopyrroles
Alternative Parents Aniline and substituted anilines  2,3,5-trisubstituted thiophenes  Pyridazinones  N-methylpyrroles  Heteroaromatic compounds  Sulfoxides  Lactams  Sulfinyl compounds  Azacyclic compounds  Primary amines  Organopnictogen compounds  Organooxygen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Aniline or substituted anilines - 2,3,5-trisubstituted thiophene - Thienopyrrole - Pyridazinone - Monocyclic benzene moiety - N-methylpyrrole - Pyridazine - Substituted pyrrole - Benzenoid - Pyrrole - Heteroaromatic compound - Thiophene - Lactam - Sulfoxide - Azacycle - Sulfinyl compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Primary amine - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Amine - Organic nitrogen compound - Aromatic heteropolycyclic compound
説明This compound belongs to the class of organic compounds known as thienopyrroles. These are heterocyclic compounds containing a thiophene ring fused to a pyrrole ring. Thiophene is 5-membered ring consisting of four carbon atoms and one sulfur atom. Pyrrole is 5-membered ring consisting of four carbon atoms and one nitrogen atom.
External Descriptors Not available
3 D構造
インタラクティブ化学構造モデル





関連ターゲット(人間)
PKM Tchem Pyruvate kinase PKM (0 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
HT-29 (80576 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
SF-126 (160 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
SW480 (6023 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
U-251 (51189 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
U2OS (164939 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
U-87 MG (3946 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
A549 (127892 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HCT-116 (91556 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HepG2 (196354 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
MDA-MB-231 (73002 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
U-118-MG (352 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
関連ターゲット(非人間)
Hdac6 Histone deacetylase 6 (222 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Pkm Pyruvate kinase isozymes M1/M2 (66 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Pklr Pyruvate kinase isozymes R/L (113 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
C6 (2371 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
NIH3T3 (5395 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
rep Replicase polyprotein 1ab (378 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
作用メカニズム
証明書(CoA、COO、BSE/TSEと分析図)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

10 results found

Lot NumberCertificate Type日付商品
D2312462D2312462Certificate of AnalysisJan 20, 2026 M333473
D2312464D2312464Certificate of AnalysisJan 20, 2026 M333473
D2312465D2312465Certificate of AnalysisJan 20, 2026 M333473
D2312467D2312467Certificate of AnalysisJan 20, 2026 M333473
D2312468D2312468Certificate of AnalysisJan 20, 2026 M333473
D2312469D2312469Certificate of AnalysisJan 20, 2026 M333473
D2312470D2312470Certificate of AnalysisJan 20, 2026 M333473
D2312471D2312471Certificate of AnalysisJan 20, 2026 M333473
D2312472D2312472Certificate of AnalysisJan 20, 2026 M333473
D2312552D2312552Certificate of AnalysisJan 20, 2026 M333473
化学的性質と物理的性質
溶解度Soluble in DMSO (~10 mg/ml).
屈折率n20D1.81 (Predicted)
沸点(°C)~711.6° C at 760 mmHg (Predicted)
分子量372.500 g/mol
XLogP31.300
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass372.071 Da
Monoisotopic Mass372.071 Da
Topological Polar Surface Area128.000 Ų
Heavy Atom Count25
Formal Charge0
Complexity601.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
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