![N-[(4-acetylphenyl)carbamothioyl]-3-methylbenzamide structure](/static/products/4288/428839-62-7.webp)
N-[(4-acetylphenyl)carbamothioyl]-3-methylbenzamide
TL;DR: N-[(4-acetylphenyl)carbamothioyl]-3-methylbenzamide (CAS 428839-62-7) is a chemical compound with molecular formula C17H16N2O2S and molecular weight 312.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-acetylphenyl)carbamothioyl]-3-methylbenzamide
Also Known As: N-[(4-acetylphenyl)carbamothioyl]-3-methylbenzamide, AB00109845-01, AN-648/40682060, N-(4-acetylphenyl)-N'-(3-methylbenzoyl)thiourea, N-(4-Acetylphenyl)-N/'-(3-methylbenzoyl)thiourea
| Molecular Formula | C17H16N2O2S |
|---|---|
| Molecular Weight | 312.09 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 90.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 312.09326 |
| Heavy Atoms | 22 |
| Complexity | 430.0 |
Chemical Identifiers
| CAS Number | 428839-62-7 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)C |
| InChIKey | TYCCCPUONNGUGR-UHFFFAOYSA-N |
Product Overview
N-[(4-acetylphenyl)carbamothioyl]-3-methylbenzamide (CAS 428839-62-7), with molecular formula C17H16N2O2S and molecular weight 312.09 g/mol. IUPAC: N-[(4-acetylphenyl)carbamothioyl]-3-methylbenzamide.
Chemical Property Profile of N-[(4-acetylphenyl)carbamothioyl]-3-methylbenzamide
Property Insights of N-[(4-acetylphenyl)carbamothioyl]-3-methylbenzamide
The XLogP value of 3.6 indicates that N-[(4-acetylphenyl)carbamothioyl]-3-methylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.3 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(4-acetylphenyl)carbamothioyl]-3-methylbenzamide. Following Lipinski's Rule of Five, N-[(4-acetylphenyl)carbamothioyl]-3-methylbenzamide 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 N-[(4-acetylphenyl)carbamothioyl]-3-methylbenzamide?
The CAS number of N-[(4-acetylphenyl)carbamothioyl]-3-methylbenzamide is 428839-62-7.
What is the molecular formula of N-[(4-acetylphenyl)carbamothioyl]-3-methylbenzamide?
The molecular formula of N-[(4-acetylphenyl)carbamothioyl]-3-methylbenzamide is C17H16N2O2S.
What is the molecular weight of N-[(4-acetylphenyl)carbamothioyl]-3-methylbenzamide?
The molecular weight of N-[(4-acetylphenyl)carbamothioyl]-3-methylbenzamide is 312.09 g/mol.
Where can I buy N-[(4-acetylphenyl)carbamothioyl]-3-methylbenzamide?
You can request a quote for N-[(4-acetylphenyl)carbamothioyl]-3-methylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(4-acetylphenyl)carbamothioyl]-3-methylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(4-acetylphenyl)carbamothioyl]-3-methylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.