MPI-5a - ≥98% , CAS No.1259296-46-2

CAS: 1259296-46-2 Cat. No.: M412352 분자식: C16H17N3O3 분자량: 299.32
주문 가능
GRADE & PURITY ≥98%
Synonyms
1,2,3,4-tetrahydro-N-hydroxy-2-[(1-methyl-1H-pyrrol-2-yl)carbonyl]-6-isoquinolinecarboxamide | MPI_5a | Histone Deacetylase 6
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
★
Size
USA
독일 (EU)*
Price
Qty
5mg
M412352-5mg
2 재고 있음
—

US$16.90

US$25.90
저장 US$9.00 (34.75%)
10mg
M412352-10mg
1 재고 있음
—

US$29.90

US$44.90
저장 US$15.00 (33.41%)
25mg
M412352-25mg
1 재고 있음
—

US$64.90

US$97.90
저장 US$33.00 (33.71%)
50mg
M412352-50mg
1 재고 있음
—

US$109.90

US$164.90
저장 US$55.00 (33.35%)
100mg
M412352-100mg
주문제작 · 8~12주

US$186.90

US$280.90
저장 US$94.00 (33.46%)
Enter a quantity for the sizes you want to add.
🧪
Why this grade

≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at -20°C Ships Ice chest + Ice pads Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

개요

Information

MPI-5a is a potent and selective inhibitor of HDAC6 with IC50 of 36 nM. MPI-5a inhibits acyl-tubulin accumulation in cells with IC50 of 210 nM.

Specifications

동의어
1,2,3,4-tetrahydro-N-hydroxy-2-[(1-methyl-1H-pyrrol-2-yl)carbonyl]-6-isoquinolinecarboxamide | MPI_5a | Histone Deacetylase 6
사양 및 순도
≥98%
생화학 및 생리적 메커니즘
MPI-5a is a potent and selective inhibitor of HDAC6 with IC50 of 36 nM. MPI-5a inhibits acyl-tubulin accumulation in cells with IC50 of 210 nM.
보관 조건
Store at -20°C
배송
Ice chest + Ice pads
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작업 유형
INHIBITOR
순수함
≥98%
이름과 식별자
Pubchem Sid
정식 스마일
CN1C=CC=C1C(=O)N2CCC3=C(C2)C=CC(=C3)C(=O)NO
IUPAC Name
N-hydroxy-2-(1-methylpyrrole-2-carbonyl)-3,4-dihydro-1H-isoquinoline-6-carboxamide
InChIKey
NNQAQGDSGCGFER-UHFFFAOYSA-N
INCHI
1S/C16H17N3O3/c1-18-7-2-3-14(18)16(21)19-8-6-11-9-12(15(20)17-22)4-5-13(11)10-19/h2-5,7,9,22H,6,8,10H2,1H3,(H,17,20)
이성체 SMILES
CN1C=CC=C1C(=O)N2CCC3=C(C2)C=CC(=C3)C(=O)NO
분자량
299.32
Reaxy-Rn
21061732
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=21061732&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
분류Tetrahydroisoquinolines
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentTetrahydroisoquinolines
Alternative Parents Pyrrole carboxamides  2-heteroaryl carboxamides  N-methylpyrroles  Benzenoids  Tertiary carboxylic acid amides  Heteroaromatic compounds  Tertiary amines  Hydroxamic acids  Amino acids and derivatives  Azacyclic compounds  Organooxygen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Tetrahydroisoquinoline - 2-heteroaryl carboxamide - Pyrrole-2-carboxamide - Pyrrole-2-carboxylic acid or derivatives - N-methylpyrrole - Substituted pyrrole - Benzenoid - Heteroaromatic compound - Tertiary carboxylic acid amide - Pyrrole - Carboxamide group - Tertiary amine - Amino acid or derivatives - Hydroxamic acid - Azacycle - Carboxylic acid derivative - Organonitrogen compound - Amine - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
설명This compound belongs to the class of organic compounds known as tetrahydroisoquinolines. These are tetrahydrogenated isoquinoline derivatives.
External Descriptors Not available
3D 구조
상호 작용 화학 구조 모델





관련 대상(인간)
HDAC6 Tclin Histone deacetylase 6 (4 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
HDAC8 Tclin Histone deacetylase 8 (4516 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HDAC10 Tclin Histone deacetylase 10 (801 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HDAC2 Tclin Histone deacetylase 2 (3971 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HDAC3 Tclin Histone deacetylase 3 (3654 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HDAC4 Tclin Histone deacetylase 4 (2328 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HDAC11 Tclin Histone deacetylase 11 (967 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HDAC7 Tclin Histone deacetylase 7 (1047 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
MMP17 Tchem Matrix metalloproteinase 17 (28 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Caco-2 (12174 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
관련 대상(비인간)
Mmp2 Matrix metalloproteinase-2 (12 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Hdac1 Histone deacetylase 1 (93 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Hdac5 Histone deacetylase 5 (5 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Hdac6 Histone deacetylase 6 (222 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mmp9 Matrix metalloproteinase 9 (38 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
작용 메커니즘
인증서(CoA, COO, BSE/TSE 및 분석 차트)
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.

9 results found

Lot NumberCertificate Type날짜항목
C2421545Certificate of AnalysisFeb 29, 2024 M412352
C2421546Certificate of AnalysisFeb 29, 2024 M412352
C2421547Certificate of AnalysisFeb 29, 2024 M412352
C2421548Certificate of AnalysisFeb 29, 2024 M412352
C2421549Certificate of AnalysisFeb 29, 2024 M412352
C2421550Certificate of AnalysisFeb 29, 2024 M412352
C2421551Certificate of AnalysisFeb 29, 2024 M412352
C2421552Certificate of AnalysisFeb 29, 2024 M412352
C2421553Certificate of AnalysisFeb 29, 2024 M412352
화학 및 물리적 특성
분자량299.320 g/mol
XLogP30.800
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass299.127 Da
Monoisotopic Mass299.127 Da
Topological Polar Surface Area74.600 Ų
Heavy Atom Count22
Formal Charge0
Complexity442.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
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