3-amino-N-(4-methoxyphenyl)-3-thioxopropanamide
TL;DR: 3-amino-N-(4-methoxyphenyl)-3-thioxopropanamide (CAS 102817-90-3) is a chemical compound with molecular formula C10H12N2O2S and molecular weight 224.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-N-(4-methoxyphenyl)-3-sulfanylidenepropanamide
Also Known As: 3-amino-N-(4-methoxyphenyl)-3-thioxopropanamide, 3-amino-N-(4-methoxyphenyl)-3-thioxopropan-amide, AF-407/08799008, 3-amino-N-(4-methoxyphenyl)-3-sulfanylidenepropanamide
| Molecular Formula | C10H12N2O2S |
|---|---|
| Molecular Weight | 224.06 g/mol |
| LogP | 1.3099 |
| Topological Polar Surface Area | 64.35 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 224.06195 |
| Heavy Atoms | 15 |
| Complexity | 362.19006 |
Chemical Identifiers
| CAS Number | 102817-90-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(=O)CC(=S)N |
Product Overview
3-amino-N-(4-methoxyphenyl)-3-thioxopropanamide (CAS 102817-90-3), with molecular formula C10H12N2O2S and molecular weight 224.06 g/mol. IUPAC: 3-amino-N-(4-methoxyphenyl)-3-sulfanylidenepropanamide.
Chemical Property Profile of 3-amino-N-(4-methoxyphenyl)-3-thioxopropanamide
Property Insights of 3-amino-N-(4-methoxyphenyl)-3-thioxopropanamide
The XLogP value of 1.3099 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-amino-N-(4-methoxyphenyl)-3-thioxopropanamide. The TPSA of 64.35 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-amino-N-(4-methoxyphenyl)-3-thioxopropanamide. Following Lipinski's Rule of Five, 3-amino-N-(4-methoxyphenyl)-3-thioxopropanamide 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 3-amino-N-(4-methoxyphenyl)-3-thioxopropanamide?
The CAS number of 3-amino-N-(4-methoxyphenyl)-3-thioxopropanamide is 102817-90-3.
What is the molecular formula of 3-amino-N-(4-methoxyphenyl)-3-thioxopropanamide?
The molecular formula of 3-amino-N-(4-methoxyphenyl)-3-thioxopropanamide is C10H12N2O2S.
What is the molecular weight of 3-amino-N-(4-methoxyphenyl)-3-thioxopropanamide?
The molecular weight of 3-amino-N-(4-methoxyphenyl)-3-thioxopropanamide is 224.06 g/mol.
Where can I buy 3-amino-N-(4-methoxyphenyl)-3-thioxopropanamide?
You can request a quote for 3-amino-N-(4-methoxyphenyl)-3-thioxopropanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-amino-N-(4-methoxyphenyl)-3-thioxopropanamide?
Yes, KEHONG BIO provides custom synthesis services for 3-amino-N-(4-methoxyphenyl)-3-thioxopropanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.