2-Carbamothioyl-3-(2-hydroxyphenyl)prop-2-enamide
TL;DR: 2-Carbamothioyl-3-(2-hydroxyphenyl)prop-2-enamide (CAS 851176-07-3) is a chemical compound with molecular formula C10H10N2O2S and molecular weight 222.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-carbamothioyl-3-(2-hydroxyphenyl)prop-2-enamide
Also Known As: 2-carbamothioyl-3-(2-hydroxyphenyl)prop-2-enamide, (2E)-2-carbamothioyl-3-(2-hydroxyphenyl)prop-2-enamide, (E)-2-Carbamothioyl-3-(2-hydroxyphenyl)prop-2-enamide, (E)-3-amino-2-[(E)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]-3-sulfanylprop-2-enamide, 3-amino-2-[(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]-3-sulfanylprop-2-enamide
| Molecular Formula | C10H10N2O2S |
|---|---|
| Molecular Weight | 222.05 g/mol |
| LogP | 0.547 |
| Topological Polar Surface Area | 89.34 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 222.0463 |
| Heavy Atoms | 15 |
| Complexity | 424.80347 |
Chemical Identifiers
| CAS Number | 851176-07-3 |
|---|---|
| SMILES | C1=CC=C(C(=C1)/C=C(\C(=O)N)/C(=S)N)O |
Product Overview
2-Carbamothioyl-3-(2-hydroxyphenyl)prop-2-enamide (CAS 851176-07-3), with molecular formula C10H10N2O2S and molecular weight 222.05 g/mol. IUPAC: (E)-2-carbamothioyl-3-(2-hydroxyphenyl)prop-2-enamide.
Chemical Property Profile of 2-Carbamothioyl-3-(2-hydroxyphenyl)prop-2-enamide
Property Insights of 2-Carbamothioyl-3-(2-hydroxyphenyl)prop-2-enamide
The XLogP value of 0.547 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Carbamothioyl-3-(2-hydroxyphenyl)prop-2-enamide. The TPSA of 89.34 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Carbamothioyl-3-(2-hydroxyphenyl)prop-2-enamide. Following Lipinski's Rule of Five, 2-Carbamothioyl-3-(2-hydroxyphenyl)prop-2-enamide has 3 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-Carbamothioyl-3-(2-hydroxyphenyl)prop-2-enamide?
The CAS number of 2-Carbamothioyl-3-(2-hydroxyphenyl)prop-2-enamide is 851176-07-3.
What is the molecular formula of 2-Carbamothioyl-3-(2-hydroxyphenyl)prop-2-enamide?
The molecular formula of 2-Carbamothioyl-3-(2-hydroxyphenyl)prop-2-enamide is C10H10N2O2S.
What is the molecular weight of 2-Carbamothioyl-3-(2-hydroxyphenyl)prop-2-enamide?
The molecular weight of 2-Carbamothioyl-3-(2-hydroxyphenyl)prop-2-enamide is 222.05 g/mol.
Where can I buy 2-Carbamothioyl-3-(2-hydroxyphenyl)prop-2-enamide?
You can request a quote for 2-Carbamothioyl-3-(2-hydroxyphenyl)prop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Carbamothioyl-3-(2-hydroxyphenyl)prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for 2-Carbamothioyl-3-(2-hydroxyphenyl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.