![(2Z)-2-cyano-3-{[3-(trifluoromethyl)phenyl]amino}prop-2-enethioamide structure](/static/products/2999/299935-95-8.webp)
(2Z)-2-cyano-3-{[3-(trifluoromethyl)phenyl]amino}prop-2-enethioamide
TL;DR: (2Z)-2-cyano-3-{[3-(trifluoromethyl)phenyl]amino}prop-2-enethioamide (CAS 299935-95-8) is a chemical compound with molecular formula C11H8F3N3S and molecular weight 271.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-2-cyano-3-[3-(trifluoromethyl)anilino]prop-2-enethioamide
Also Known As: (Z)-2-cyano-3-[3-(trifluoromethyl)anilino]prop-2-enethioamide, (2Z)-2-cyano-3-{[3-(trifluoromethyl)phenyl]amino}prop-2-enethioamide, (Z)-2-cyano-3-((3-(trifluoromethyl)phenyl)amino)prop-2-enethioamide
| Molecular Formula | C11H8F3N3S |
|---|---|
| Molecular Weight | 271.04 g/mol |
| LogP | 2.81088 |
| Topological Polar Surface Area | 61.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 271.0391 |
| Heavy Atoms | 18 |
| Complexity | 529.0704 |
Chemical Identifiers
| CAS Number | 299935-95-8 |
|---|---|
| SMILES | C1=CC(=CC(=C1)N/C=C(/C#N)\C(=S)N)C(F)(F)F |
Product Overview
(2Z)-2-cyano-3-{[3-(trifluoromethyl)phenyl]amino}prop-2-enethioamide (CAS 299935-95-8), with molecular formula C11H8F3N3S and molecular weight 271.04 g/mol. IUPAC: (Z)-2-cyano-3-[3-(trifluoromethyl)anilino]prop-2-enethioamide.
Chemical Property Profile of (2Z)-2-cyano-3-{[3-(trifluoromethyl)phenyl]amino}prop-2-enethioamide
Property Insights of (2Z)-2-cyano-3-{[3-(trifluoromethyl)phenyl]amino}prop-2-enethioamide
The XLogP value of 2.81088 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2Z)-2-cyano-3-{[3-(trifluoromethyl)phenyl]amino}prop-2-enethioamide. The TPSA of 61.84 Ų falls within the moderate polarity range, balancing permeability and solubility for (2Z)-2-cyano-3-{[3-(trifluoromethyl)phenyl]amino}prop-2-enethioamide. Following Lipinski's Rule of Five, (2Z)-2-cyano-3-{[3-(trifluoromethyl)phenyl]amino}prop-2-enethioamide has 2 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 (2Z)-2-cyano-3-{[3-(trifluoromethyl)phenyl]amino}prop-2-enethioamide?
The CAS number of (2Z)-2-cyano-3-{[3-(trifluoromethyl)phenyl]amino}prop-2-enethioamide is 299935-95-8.
What is the molecular formula of (2Z)-2-cyano-3-{[3-(trifluoromethyl)phenyl]amino}prop-2-enethioamide?
The molecular formula of (2Z)-2-cyano-3-{[3-(trifluoromethyl)phenyl]amino}prop-2-enethioamide is C11H8F3N3S.
What is the molecular weight of (2Z)-2-cyano-3-{[3-(trifluoromethyl)phenyl]amino}prop-2-enethioamide?
The molecular weight of (2Z)-2-cyano-3-{[3-(trifluoromethyl)phenyl]amino}prop-2-enethioamide is 271.04 g/mol.
Where can I buy (2Z)-2-cyano-3-{[3-(trifluoromethyl)phenyl]amino}prop-2-enethioamide?
You can request a quote for (2Z)-2-cyano-3-{[3-(trifluoromethyl)phenyl]amino}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 (2Z)-2-cyano-3-{[3-(trifluoromethyl)phenyl]amino}prop-2-enethioamide?
Yes, KEHONG BIO provides custom synthesis services for (2Z)-2-cyano-3-{[3-(trifluoromethyl)phenyl]amino}prop-2-enethioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.