2-cyano-3-(1H-indol-3-yl)acrylamide
TL;DR: 2-cyano-3-(1H-indol-3-yl)acrylamide (CAS 129180-04-7) is a chemical compound with molecular formula C12H9N3O and molecular weight 211.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-cyano-3-(1H-indol-3-yl)prop-2-enamide
Also Known As: 2-cyano-3-(1H-indol-3-yl)acrylamide, Indole-Containing Inhibitor 10, (E)-2-cyano-3-(1H-indol-3-yl)acrylamide, 2-Cyano-3-(1H-indol-3-yl)propenamide, 2-CYANO-3(3'-INDOLYL)ACRYLAMIDE
| Molecular Formula | C12H9N3O |
|---|---|
| Molecular Weight | 211.07 g/mol |
| LogP | 1.56018 |
| Topological Polar Surface Area | 82.67 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 211.07455 |
| Heavy Atoms | 16 |
| Complexity | 616.47076 |
Chemical Identifiers
| CAS Number | 129180-04-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2)/C=C(\C#N)/C(=O)N |
Product Overview
2-cyano-3-(1H-indol-3-yl)acrylamide (CAS 129180-04-7), with molecular formula C12H9N3O and molecular weight 211.07 g/mol. IUPAC: (E)-2-cyano-3-(1H-indol-3-yl)prop-2-enamide.
Chemical Property Profile of 2-cyano-3-(1H-indol-3-yl)acrylamide
Property Insights of 2-cyano-3-(1H-indol-3-yl)acrylamide
The XLogP value of 1.56018 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-cyano-3-(1H-indol-3-yl)acrylamide. The TPSA of 82.67 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-cyano-3-(1H-indol-3-yl)acrylamide. Following Lipinski's Rule of Five, 2-cyano-3-(1H-indol-3-yl)acrylamide has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-cyano-3-(1H-indol-3-yl)acrylamide?
The CAS number of 2-cyano-3-(1H-indol-3-yl)acrylamide is 129180-04-7.
What is the molecular formula of 2-cyano-3-(1H-indol-3-yl)acrylamide?
The molecular formula of 2-cyano-3-(1H-indol-3-yl)acrylamide is C12H9N3O.
What is the molecular weight of 2-cyano-3-(1H-indol-3-yl)acrylamide?
The molecular weight of 2-cyano-3-(1H-indol-3-yl)acrylamide is 211.07 g/mol.
Where can I buy 2-cyano-3-(1H-indol-3-yl)acrylamide?
You can request a quote for 2-cyano-3-(1H-indol-3-yl)acrylamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-cyano-3-(1H-indol-3-yl)acrylamide?
Yes, KEHONG BIO provides custom synthesis services for 2-cyano-3-(1H-indol-3-yl)acrylamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.