2-Cyano-3-(3-thienyl)-2-propenethioamide
TL;DR: 2-Cyano-3-(3-thienyl)-2-propenethioamide (CAS 160349-67-7) is a chemical compound with molecular formula C8H6N2S2 and molecular weight 194.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-cyano-3-thiophen-3-ylprop-2-enethioamide
Also Known As: 2-cyano-3-(3-thienyl)-2-propenethioamide, 2-cyano-3-(3-thienyl)-2-propenthioamide, (E)-2-cyano-3-thiophen-3-ylprop-2-enethioamide
| Molecular Formula | C8H6N2S2 |
|---|---|
| Molecular Weight | 194.00 g/mol |
| LogP | 1.94118 |
| Topological Polar Surface Area | 49.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 193.99724 |
| Heavy Atoms | 12 |
| Complexity | 343.6348 |
Chemical Identifiers
| CAS Number | 160349-67-7 |
|---|---|
| SMILES | C1=CSC=C1/C=C(\C#N)/C(=S)N |
Product Overview
2-Cyano-3-(3-thienyl)-2-propenethioamide (CAS 160349-67-7), with molecular formula C8H6N2S2 and molecular weight 194.00 g/mol. IUPAC: (E)-2-cyano-3-thiophen-3-ylprop-2-enethioamide.
Chemical Property Profile of 2-Cyano-3-(3-thienyl)-2-propenethioamide
Property Insights of 2-Cyano-3-(3-thienyl)-2-propenethioamide
The XLogP value of 1.94118 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Cyano-3-(3-thienyl)-2-propenethioamide. With a topological polar surface area (TPSA) of 49.81 Ų, 2-Cyano-3-(3-thienyl)-2-propenethioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Cyano-3-(3-thienyl)-2-propenethioamide 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-(3-thienyl)-2-propenethioamide?
The CAS number of 2-Cyano-3-(3-thienyl)-2-propenethioamide is 160349-67-7.
What is the molecular formula of 2-Cyano-3-(3-thienyl)-2-propenethioamide?
The molecular formula of 2-Cyano-3-(3-thienyl)-2-propenethioamide is C8H6N2S2.
What is the molecular weight of 2-Cyano-3-(3-thienyl)-2-propenethioamide?
The molecular weight of 2-Cyano-3-(3-thienyl)-2-propenethioamide is 194.00 g/mol.
Where can I buy 2-Cyano-3-(3-thienyl)-2-propenethioamide?
You can request a quote for 2-Cyano-3-(3-thienyl)-2-propenethioamide 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-(3-thienyl)-2-propenethioamide?
Yes, KEHONG BIO provides custom synthesis services for 2-Cyano-3-(3-thienyl)-2-propenethioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.