(Z)-2-cyano-3-(5-methylthiophen-2-yl)prop-2-enethioamide
TL;DR: (Z)-2-cyano-3-(5-methylthiophen-2-yl)prop-2-enethioamide (CAS 329693-89-2) is a chemical compound with molecular formula C9H8N2S2 and molecular weight 208.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-2-cyano-3-(5-methylthiophen-2-yl)prop-2-enethioamide
Also Known As: (Z)-2-cyano-3-(5-methylthiophen-2-yl)prop-2-enethioamide, AB00091811-01, 2-cyano-3-(5-methylthiophen-2-yl)prop-2-enethioamide, (2Z)-2-(aminothioxomethyl)-3-(5-methyl(2-thienyl))prop-2-enenitrile, (2Z)-2-cyano-3-(5-methylthiophen-2-yl)prop-2-enethioamide
| Molecular Formula | C9H8N2S2 |
|---|---|
| Molecular Weight | 208.01 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 110.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 208.0129 |
| Heavy Atoms | 13 |
| Complexity | 287.0 |
Chemical Identifiers
| CAS Number | 329693-89-2 |
|---|---|
| SMILES | CC1=CC=C(S1)/C=C(/C#N)\C(=S)N |
| InChIKey | KLYBECOZYYCTCC-DAXSKMNVSA-N |
Product Overview
(Z)-2-cyano-3-(5-methylthiophen-2-yl)prop-2-enethioamide (CAS 329693-89-2), with molecular formula C9H8N2S2 and molecular weight 208.01 g/mol. IUPAC: (Z)-2-cyano-3-(5-methylthiophen-2-yl)prop-2-enethioamide.
Chemical Property Profile of (Z)-2-cyano-3-(5-methylthiophen-2-yl)prop-2-enethioamide
Property Insights of (Z)-2-cyano-3-(5-methylthiophen-2-yl)prop-2-enethioamide
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-2-cyano-3-(5-methylthiophen-2-yl)prop-2-enethioamide. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-2-cyano-3-(5-methylthiophen-2-yl)prop-2-enethioamide. Following Lipinski's Rule of Five, (Z)-2-cyano-3-(5-methylthiophen-2-yl)prop-2-enethioamide 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 (Z)-2-cyano-3-(5-methylthiophen-2-yl)prop-2-enethioamide?
The CAS number of (Z)-2-cyano-3-(5-methylthiophen-2-yl)prop-2-enethioamide is 329693-89-2.
What is the molecular formula of (Z)-2-cyano-3-(5-methylthiophen-2-yl)prop-2-enethioamide?
The molecular formula of (Z)-2-cyano-3-(5-methylthiophen-2-yl)prop-2-enethioamide is C9H8N2S2.
What is the molecular weight of (Z)-2-cyano-3-(5-methylthiophen-2-yl)prop-2-enethioamide?
The molecular weight of (Z)-2-cyano-3-(5-methylthiophen-2-yl)prop-2-enethioamide is 208.01 g/mol.
Where can I buy (Z)-2-cyano-3-(5-methylthiophen-2-yl)prop-2-enethioamide?
You can request a quote for (Z)-2-cyano-3-(5-methylthiophen-2-yl)prop-2-enethioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-2-cyano-3-(5-methylthiophen-2-yl)prop-2-enethioamide?
Yes, KEHONG BIO provides custom synthesis services for (Z)-2-cyano-3-(5-methylthiophen-2-yl)prop-2-enethioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.