2-amino-4-(1H-indol-5-yl)buta-1,3-diene-1,1,3-tricarbonitrile
Basic information
- CAS
133550-06-8- Standard SMILES
N#CC(=Cc1ccc2[nH]ccc2c1)C(N)=C(C#N)C#N- InChIKey
CMMDWEJTQUTCKG-UHFFFAOYSA-N- Molecular formula
- C15H9N5
- Average molar mass
- 259.27 g/mol
- Monoisotopic mass
- 259.08579531
Overview
Tyrphostin AG 370 is a member of the Tyrphostin family of tyrosine kinase inhibitors that inhibits platelet derived growth factor (PDGF), autophosphorylation and PDGF-induced mitogenesis in fibroblast. (NCI)
Names & identifiers
- Preferred name
- 2-amino-4-(1H-indol-5-yl)buta-1,3-diene-1,1,3-tricarbonitrile
- IUPAC
- 2-amino-4-(1H-indol-5-yl)buta-1,3-diene-1,1,3-tricarbonitrile
Names & synonyms
2-amino-4-(1H-indol-5-yl)buta-1,3-diene-1,1,3-tricarbonitrile133550-06-8TYRPHOSTIN B7AG-370134036-53-6Tyrphostin AG 370CBiol_001925KBioGR_000114KBioGR_000534KBioSS_000114KBioSS_000534orb1704967
Show more names
SCHEMBL2956923KBio2_000114KBio2_000534KBio2_002682KBio2_003102KBio2_005250KBio2_005670KBio3_000227
Database identifiers
- CAS
133550-06-8、134036-53-6- PubChem CID
- 2042
- DTXSID
DTXSID40274349
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 113 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 582
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Related reactions
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Compound notes
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