N-(3-cyano-2-thienyl)-2-(1H-1,2,4-triazol-3-ylthio)acetamide
TL;DR: N-(3-cyano-2-thienyl)-2-(1H-1,2,4-triazol-3-ylthio)acetamide (CAS 690646-92-5) is a chemical compound with molecular formula C9H7N5OS2 and molecular weight 265.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-cyanothiophen-2-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide
Also Known As: CBKinase1_007652, CBKinase1_020052, UPCMLD0ENAT5671274:001, VU0174722-5, N-(3-cyano-2-thienyl)-2-(1H-1,2,4-triazol-3-ylthio)acetamide
| Molecular Formula | C9H7N5OS2 |
|---|---|
| Molecular Weight | 265.01 g/mol |
| LogP | 1.46868 |
| Topological Polar Surface Area | 94.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 265.00922 |
| Heavy Atoms | 17 |
| Complexity | 541.98724 |
Chemical Identifiers
| CAS Number | 690646-92-5 |
|---|---|
| SMILES | C1=CSC(=C1C#N)NC(=O)CSC2=NC=NN2 |
Product Overview
N-(3-cyano-2-thienyl)-2-(1H-1,2,4-triazol-3-ylthio)acetamide (CAS 690646-92-5), with molecular formula C9H7N5OS2 and molecular weight 265.01 g/mol. IUPAC: N-(3-cyanothiophen-2-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide.
Chemical Property Profile of N-(3-cyano-2-thienyl)-2-(1H-1,2,4-triazol-3-ylthio)acetamide
Property Insights of N-(3-cyano-2-thienyl)-2-(1H-1,2,4-triazol-3-ylthio)acetamide
The XLogP value of 1.46868 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-cyano-2-thienyl)-2-(1H-1,2,4-triazol-3-ylthio)acetamide. The TPSA of 94.46 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-cyano-2-thienyl)-2-(1H-1,2,4-triazol-3-ylthio)acetamide. Following Lipinski's Rule of Five, N-(3-cyano-2-thienyl)-2-(1H-1,2,4-triazol-3-ylthio)acetamide has 2 hydrogen bond donor(s) and 6 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 N-(3-cyano-2-thienyl)-2-(1H-1,2,4-triazol-3-ylthio)acetamide?
The CAS number of N-(3-cyano-2-thienyl)-2-(1H-1,2,4-triazol-3-ylthio)acetamide is 690646-92-5.
What is the molecular formula of N-(3-cyano-2-thienyl)-2-(1H-1,2,4-triazol-3-ylthio)acetamide?
The molecular formula of N-(3-cyano-2-thienyl)-2-(1H-1,2,4-triazol-3-ylthio)acetamide is C9H7N5OS2.
What is the molecular weight of N-(3-cyano-2-thienyl)-2-(1H-1,2,4-triazol-3-ylthio)acetamide?
The molecular weight of N-(3-cyano-2-thienyl)-2-(1H-1,2,4-triazol-3-ylthio)acetamide is 265.01 g/mol.
Where can I buy N-(3-cyano-2-thienyl)-2-(1H-1,2,4-triazol-3-ylthio)acetamide?
You can request a quote for N-(3-cyano-2-thienyl)-2-(1H-1,2,4-triazol-3-ylthio)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-cyano-2-thienyl)-2-(1H-1,2,4-triazol-3-ylthio)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-cyano-2-thienyl)-2-(1H-1,2,4-triazol-3-ylthio)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.