DAPI - Moligand™, ≥98% , CAS No.47165-04-8

CAS: 47165-04-8 Cat. No.: D609734 分子式: C₁₆H₁₅N₅ 分子量: 277.32 PubChem CID: 2954

グレード＆純度 Moligand™, ≥98%

Synonyms

dapi|4',6-Diamidino-2-phenylindole|47165-04-8|2-(4-carbamimidoylphenyl)-1H-indole-6-carboximidamide|4',6-Diamidinophenyl-indole|2-(4-(Aminoiminomethyl)phenyl)-1H-indole-6-carboximidamide|CHEBI:51231|K9W25Z7ROH|6-AMIDINE-2-(4-AMIDINO-PHENYL)INDOLE|2-(4-car

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

仕様

同義語

dapi | 4',6-Diamidino-2-phenylindole | 47165-04-8 | 2-(4-carbamimidoylphenyl)-1H-indole-6-carboximidamide | 4',6-Diamidinophenyl-indole | 2-(4-(Aminoiminomethyl)phenyl)-1H-indole-6-carboximidamide | CHEBI:51231 | K9W25Z7ROH | 6-AMIDINE-2-(4-AMIDINO-PHENYL)INDOLE | 2-(4-car

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™

純度

≥98%

名前と識別子

パブケム・シド

528764087

カノニカル・スマイル

NC(=N)c1ccc(cc1)c1cc2c([nH]1)cc(cc2)C(=N)N

IUPAC Name

2-(4-carbamimidoylphenyl)-1H-indole-6-carboximidamide

InChIKey

FWBHETKCLVMNFS-UHFFFAOYSA-N

INCHI

1S/C16H15N5/c17-15(18)10-3-1-9(2-4-10)13-7-11-5-6-12(16(19)20)8-14(11)21-13/h1-8,21H,(H3,17,18)(H3,19,20)

異性体SMILES

C1=CC(=CC=C1C2=CC3=C(N2)C=C(C=C3)C(=N)N)C(=N)N

PubChem CID

2954

分子量

277.32

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • 分類 Indoles and derivatives
      • Subclass Indoles

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• 分類: Indoles and derivatives
• Subclass: Indoles
• Intermediate Tree Nodes: Not available
• Direct Parent: 2-phenylindoles
• Alternative Parents: Phenylpyrroles Benzene and substituted derivatives Heteroaromatic compounds Carboximidamides Carboxamidines Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: 2-phenylindole - 2-phenylpyrrole - Monocyclic benzene moiety - Substituted pyrrole - Benzenoid - Pyrrole - Heteroaromatic compound - Amidine - Carboxylic acid amidine - Azacycle - Carboximidamide - Organonitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteropolycyclic compound
• 説明: This compound belongs to the class of organic compounds known as 2-phenylindoles. These are indoles substituted at the 2-position with a phenyl group.
• External Descriptors: indoles

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

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作用メカニズム

化学的性質と物理的性質

• 分子量: 277.320 g/mol
• XLogP3: 1.600
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 277.133 Da
• Monoisotopic Mass: 277.133 Da
• Topological Polar Surface Area: 116.000 Ų
• Heavy Atom Count: 21
• Formal Charge: 0
• Complexity: 413.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1