(2E)-2-cyano-3-(thiophen-2-yl)-N-(4H-1,2,4-triazol-4-yl)prop-2-enamide
TL;DR: (2E)-2-cyano-3-(thiophen-2-yl)-N-(4H-1,2,4-triazol-4-yl)prop-2-enamide (CAS 301201-92-3) is a chemical compound with molecular formula C10H7N5OS and molecular weight 245.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-cyano-3-thiophen-2-yl-N-(1,2,4-triazol-4-yl)prop-2-enamide
Also Known As: BAS 01370453, (2E)-2-cyano-3-(thiophen-2-yl)-N-(4H-1,2,4-triazol-4-yl)prop-2-enamide, 2-Cyano-3-thiophen-2-yl-N-[1,2,4]triazol-4-yl-acrylamide, (E)-2-cyano-3-(thiophen-2-yl)-N-(4H-1,2,4-triazol-4-yl)acrylamide, (E)-2-cyano-3-thiophen-2-yl-N-(1,2,4-triazol-4-yl)prop-2-enamide
| Molecular Formula | C10H7N5OS |
|---|---|
| Molecular Weight | 245.04 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 245.03712 |
| Heavy Atoms | 17 |
| Complexity | 368.0 |
Chemical Identifiers
| CAS Number | 301201-92-3 |
|---|---|
| SMILES | C1=CSC(=C1)/C=C(\C#N)/C(=O)NN2C=NN=C2 |
| InChIKey | PYBLBKKIMYZEHN-XBXARRHUSA-N |
Product Overview
(2E)-2-cyano-3-(thiophen-2-yl)-N-(4H-1,2,4-triazol-4-yl)prop-2-enamide (CAS 301201-92-3), with molecular formula C10H7N5OS and molecular weight 245.04 g/mol. IUPAC: (E)-2-cyano-3-thiophen-2-yl-N-(1,2,4-triazol-4-yl)prop-2-enamide.
Chemical Property Profile of (2E)-2-cyano-3-(thiophen-2-yl)-N-(4H-1,2,4-triazol-4-yl)prop-2-enamide
Property Insights of (2E)-2-cyano-3-(thiophen-2-yl)-N-(4H-1,2,4-triazol-4-yl)prop-2-enamide
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-2-cyano-3-(thiophen-2-yl)-N-(4H-1,2,4-triazol-4-yl)prop-2-enamide. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-2-cyano-3-(thiophen-2-yl)-N-(4H-1,2,4-triazol-4-yl)prop-2-enamide. Following Lipinski's Rule of Five, (2E)-2-cyano-3-(thiophen-2-yl)-N-(4H-1,2,4-triazol-4-yl)prop-2-enamide has 1 hydrogen bond donor(s) and 5 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)-N-(4H-1,2,4-triazol-4-yl)prop-2-enamide?
The CAS number of (2E)-2-cyano-3-(thiophen-2-yl)-N-(4H-1,2,4-triazol-4-yl)prop-2-enamide is 301201-92-3.
What is the molecular formula of (2E)-2-cyano-3-(thiophen-2-yl)-N-(4H-1,2,4-triazol-4-yl)prop-2-enamide?
The molecular formula of (2E)-2-cyano-3-(thiophen-2-yl)-N-(4H-1,2,4-triazol-4-yl)prop-2-enamide is C10H7N5OS.
What is the molecular weight of (2E)-2-cyano-3-(thiophen-2-yl)-N-(4H-1,2,4-triazol-4-yl)prop-2-enamide?
The molecular weight of (2E)-2-cyano-3-(thiophen-2-yl)-N-(4H-1,2,4-triazol-4-yl)prop-2-enamide is 245.04 g/mol.
Where can I buy (2E)-2-cyano-3-(thiophen-2-yl)-N-(4H-1,2,4-triazol-4-yl)prop-2-enamide?
You can request a quote for (2E)-2-cyano-3-(thiophen-2-yl)-N-(4H-1,2,4-triazol-4-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)-N-(4H-1,2,4-triazol-4-yl)prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for (2E)-2-cyano-3-(thiophen-2-yl)-N-(4H-1,2,4-triazol-4-yl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.