(Z)-2-cyano-3-(4-ethylphenyl)prop-2-enethioamide
TL;DR: (Z)-2-cyano-3-(4-ethylphenyl)prop-2-enethioamide (CAS 1164518-40-4) is a chemical compound with molecular formula C12H12N2S and molecular weight 216.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-2-cyano-3-(4-ethylphenyl)prop-2-enethioamide
Also Known As: (Z)-2-cyano-3-(4-ethylphenyl)prop-2-enethioamide, (2Z)-2-CYANO-3-(4-ETHYLPHENYL)PROP-2-ENETHIOAMIDE, (Z)-2-cyano-3-(4-ethylphenyl)thioacrylamide, (Z)-2-cyano-3-(4-ethylphenyl)-2-propenethioamide, (Z)-2-cyano-3-(p-ethylphenyl)-2-propenethioamide
| Molecular Formula | C12H12N2S |
|---|---|
| Molecular Weight | 216.07 g/mol |
| LogP | 2.44208 |
| Topological Polar Surface Area | 49.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 216.07211 |
| Heavy Atoms | 15 |
| Complexity | 423.93048 |
Chemical Identifiers
| CAS Number | 1164518-40-4 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)/C=C(/C#N)\C(=S)N |
Product Overview
(Z)-2-cyano-3-(4-ethylphenyl)prop-2-enethioamide (CAS 1164518-40-4), with molecular formula C12H12N2S and molecular weight 216.07 g/mol. IUPAC: (Z)-2-cyano-3-(4-ethylphenyl)prop-2-enethioamide.
Chemical Property Profile of (Z)-2-cyano-3-(4-ethylphenyl)prop-2-enethioamide
Property Insights of (Z)-2-cyano-3-(4-ethylphenyl)prop-2-enethioamide
The XLogP value of 2.44208 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-2-cyano-3-(4-ethylphenyl)prop-2-enethioamide. With a topological polar surface area (TPSA) of 49.81 Ų, (Z)-2-cyano-3-(4-ethylphenyl)prop-2-enethioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Z)-2-cyano-3-(4-ethylphenyl)prop-2-enethioamide has 1 hydrogen bond donor(s) and 2 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-(4-ethylphenyl)prop-2-enethioamide?
The CAS number of (Z)-2-cyano-3-(4-ethylphenyl)prop-2-enethioamide is 1164518-40-4.
What is the molecular formula of (Z)-2-cyano-3-(4-ethylphenyl)prop-2-enethioamide?
The molecular formula of (Z)-2-cyano-3-(4-ethylphenyl)prop-2-enethioamide is C12H12N2S.
What is the molecular weight of (Z)-2-cyano-3-(4-ethylphenyl)prop-2-enethioamide?
The molecular weight of (Z)-2-cyano-3-(4-ethylphenyl)prop-2-enethioamide is 216.07 g/mol.
Where can I buy (Z)-2-cyano-3-(4-ethylphenyl)prop-2-enethioamide?
You can request a quote for (Z)-2-cyano-3-(4-ethylphenyl)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-(4-ethylphenyl)prop-2-enethioamide?
Yes, KEHONG BIO provides custom synthesis services for (Z)-2-cyano-3-(4-ethylphenyl)prop-2-enethioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.