(E)-N-carbamothioyl-3-(2-methoxyphenyl)acrylamide
TL;DR: (E)-N-carbamothioyl-3-(2-methoxyphenyl)acrylamide (CAS 651017-47-9) is a chemical compound with molecular formula C11H12N2O2S and molecular weight 236.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-carbamothioyl-3-(2-methoxyphenyl)prop-2-enamide
Also Known As: [3-(2-methoxyphenyl)prop-2-enoyl]thiourea|(E)-N-carbamothioyl-3-(2-methoxyphenyl)acrylamide|(E)-N-carbamothioyl-3-(2-methoxyphenyl)prop-2-enamide|N-(aminocarbonothioyl)-3-(2-methoxyphenyl)acrylamide|(2E)-N-carbamothioyl-3-(2-methoxyphenyl)prop-2-enamide|F1723-0272|(2E)-N-(aminothioxomethyl)-3-(2-methoxyphenyl)prop-2-enamide
| Molecular Formula | C11H12N2O2S |
|---|---|
| Molecular Weight | 236.06 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 96.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 236.06195 |
| Heavy Atoms | 16 |
| Complexity | 292.0 |
Chemical Identifiers
| CAS Number | 651017-47-9 |
|---|---|
| SMILES | COC1=CC=CC=C1/C=C/C(=O)NC(=S)N |
| InChIKey | XNZQGECIJYRRRU-VOTSOKGWSA-N |
Product Overview
(E)-N-carbamothioyl-3-(2-methoxyphenyl)acrylamide (CAS 651017-47-9), with molecular formula C11H12N2O2S and molecular weight 236.06 g/mol. IUPAC: (E)-N-carbamothioyl-3-(2-methoxyphenyl)prop-2-enamide.
Chemical Property Profile of (E)-N-carbamothioyl-3-(2-methoxyphenyl)acrylamide
Property Insights of (E)-N-carbamothioyl-3-(2-methoxyphenyl)acrylamide
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-N-carbamothioyl-3-(2-methoxyphenyl)acrylamide. The TPSA of 96.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N-carbamothioyl-3-(2-methoxyphenyl)acrylamide. Following Lipinski's Rule of Five, (E)-N-carbamothioyl-3-(2-methoxyphenyl)acrylamide 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 (E)-N-carbamothioyl-3-(2-methoxyphenyl)acrylamide?
The CAS number of (E)-N-carbamothioyl-3-(2-methoxyphenyl)acrylamide is 651017-47-9.
What is the molecular formula of (E)-N-carbamothioyl-3-(2-methoxyphenyl)acrylamide?
The molecular formula of (E)-N-carbamothioyl-3-(2-methoxyphenyl)acrylamide is C11H12N2O2S.
What is the molecular weight of (E)-N-carbamothioyl-3-(2-methoxyphenyl)acrylamide?
The molecular weight of (E)-N-carbamothioyl-3-(2-methoxyphenyl)acrylamide is 236.06 g/mol.
Where can I buy (E)-N-carbamothioyl-3-(2-methoxyphenyl)acrylamide?
You can request a quote for (E)-N-carbamothioyl-3-(2-methoxyphenyl)acrylamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N-carbamothioyl-3-(2-methoxyphenyl)acrylamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N-carbamothioyl-3-(2-methoxyphenyl)acrylamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.