(2E)-2-cyano-3-(thiophen-2-yl)prop-2-enamide
TL;DR: (2E)-2-cyano-3-(thiophen-2-yl)prop-2-enamide (CAS 54688-95-8) is a chemical compound with molecular formula C8H6N2OS and molecular weight 178.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-cyano-3-thiophen-2-ylprop-2-enamide
Also Known As: HcMH`IuPBDigy[JiekZAEH, (2E)-2-cyano-3-(thiophen-2-yl)prop-2-enamide, 2-cyano-3-(2-thienyl)acrylamide, 2-Cyano-3-(thiophen-2-yl)acrylamide, (e)-2-cyano-3-(thiophen-2-yl)acrylamide
| Molecular Formula | C8H6N2OS |
|---|---|
| Molecular Weight | 178.02 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 95.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 178.02008 |
| Heavy Atoms | 12 |
| Complexity | 263.0 |
Chemical Identifiers
| CAS Number | 54688-95-8 |
|---|---|
| SMILES | C1=CSC(=C1)/C=C(\C#N)/C(=O)N |
| InChIKey | BTCIBXVDLXOYIT-GQCTYLIASA-N |
Product Overview
(2E)-2-cyano-3-(thiophen-2-yl)prop-2-enamide (CAS 54688-95-8), with molecular formula C8H6N2OS and molecular weight 178.02 g/mol. IUPAC: (E)-2-cyano-3-thiophen-2-ylprop-2-enamide.
Chemical Property Profile of (2E)-2-cyano-3-(thiophen-2-yl)prop-2-enamide
Property Insights of (2E)-2-cyano-3-(thiophen-2-yl)prop-2-enamide
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-2-cyano-3-(thiophen-2-yl)prop-2-enamide. The TPSA of 95.1 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-2-cyano-3-(thiophen-2-yl)prop-2-enamide. Following Lipinski's Rule of Five, (2E)-2-cyano-3-(thiophen-2-yl)prop-2-enamide 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 (2E)-2-cyano-3-(thiophen-2-yl)prop-2-enamide?
The CAS number of (2E)-2-cyano-3-(thiophen-2-yl)prop-2-enamide is 54688-95-8.
What is the molecular formula of (2E)-2-cyano-3-(thiophen-2-yl)prop-2-enamide?
The molecular formula of (2E)-2-cyano-3-(thiophen-2-yl)prop-2-enamide is C8H6N2OS.
What is the molecular weight of (2E)-2-cyano-3-(thiophen-2-yl)prop-2-enamide?
The molecular weight of (2E)-2-cyano-3-(thiophen-2-yl)prop-2-enamide is 178.02 g/mol.
Where can I buy (2E)-2-cyano-3-(thiophen-2-yl)prop-2-enamide?
You can request a quote for (2E)-2-cyano-3-(thiophen-2-yl)prop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-2-cyano-3-(thiophen-2-yl)prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for (2E)-2-cyano-3-(thiophen-2-yl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.