2-Cyano-3-(5-methyl-2-thienyl)acrylamide
TL;DR: 2-Cyano-3-(5-methyl-2-thienyl)acrylamide (CAS 97006-47-8) is a chemical compound with molecular formula C9H8N2OS and molecular weight 192.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-cyano-3-(5-methylthiophen-2-yl)prop-2-enamide
Also Known As: 2-cyano-3-(5-methyl-2-thienyl)acrylamide, (E)-2-cyano-3-(5-methylthiophen-2-yl)prop-2-enamide, (2E)-2-cyano-3-(5-methylthiophen-2-yl)prop-2-enamide
| Molecular Formula | C9H8N2OS |
|---|---|
| Molecular Weight | 192.04 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 95.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 192.03574 |
| Heavy Atoms | 13 |
| Complexity | 289.0 |
Chemical Identifiers
| CAS Number | 97006-47-8 |
|---|---|
| SMILES | CC1=CC=C(S1)/C=C(\C#N)/C(=O)N |
| InChIKey | VUQFYZGKBHODQK-QPJJXVBHSA-N |
Product Overview
2-Cyano-3-(5-methyl-2-thienyl)acrylamide (CAS 97006-47-8), with molecular formula C9H8N2OS and molecular weight 192.04 g/mol. IUPAC: (E)-2-cyano-3-(5-methylthiophen-2-yl)prop-2-enamide.
Chemical Property Profile of 2-Cyano-3-(5-methyl-2-thienyl)acrylamide
Property Insights of 2-Cyano-3-(5-methyl-2-thienyl)acrylamide
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Cyano-3-(5-methyl-2-thienyl)acrylamide. The TPSA of 95.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Cyano-3-(5-methyl-2-thienyl)acrylamide. Following Lipinski's Rule of Five, 2-Cyano-3-(5-methyl-2-thienyl)acrylamide has 1 hydrogen bond donor(s) and 3 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-(5-methyl-2-thienyl)acrylamide?
The CAS number of 2-Cyano-3-(5-methyl-2-thienyl)acrylamide is 97006-47-8.
What is the molecular formula of 2-Cyano-3-(5-methyl-2-thienyl)acrylamide?
The molecular formula of 2-Cyano-3-(5-methyl-2-thienyl)acrylamide is C9H8N2OS.
What is the molecular weight of 2-Cyano-3-(5-methyl-2-thienyl)acrylamide?
The molecular weight of 2-Cyano-3-(5-methyl-2-thienyl)acrylamide is 192.04 g/mol.
Where can I buy 2-Cyano-3-(5-methyl-2-thienyl)acrylamide?
You can request a quote for 2-Cyano-3-(5-methyl-2-thienyl)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-(5-methyl-2-thienyl)acrylamide?
Yes, KEHONG BIO provides custom synthesis services for 2-Cyano-3-(5-methyl-2-thienyl)acrylamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.