N-({4-[acetyl(methyl)amino]phenyl}carbamothioyl)benzamide
TL;DR: N-({4-[acetyl(methyl)amino]phenyl}carbamothioyl)benzamide (CAS 496029-74-4) is a chemical compound with molecular formula C17H17N3O2S and molecular weight 327.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-[acetyl(methyl)amino]phenyl]carbamothioyl]benzamide
Also Known As: AN-329/41572353, N-({4-[acetyl(methyl)amino]phenyl}carbamothioyl)benzamide, N-[[4-[acetyl(methyl)amino]phenyl]carbamothioyl]benzamide, N-[({4-[acetyl(methyl)amino]phenyl}amino)carbonothioyl]benzamide, N-(4-{[(benzoylamino)carbothioyl]amino}phenyl)-N-methylacetamide
| Molecular Formula | C17H17N3O2S |
|---|---|
| Molecular Weight | 327.10 g/mol |
| LogP | 2.7961 |
| Topological Polar Surface Area | 61.44 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 327.10416 |
| Heavy Atoms | 23 |
| Complexity | 714.3782 |
Chemical Identifiers
| CAS Number | 496029-74-4 |
|---|---|
| SMILES | CC(=O)N(C)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=CC=C2 |
Product Overview
N-({4-[acetyl(methyl)amino]phenyl}carbamothioyl)benzamide (CAS 496029-74-4), with molecular formula C17H17N3O2S and molecular weight 327.10 g/mol. IUPAC: N-[[4-[acetyl(methyl)amino]phenyl]carbamothioyl]benzamide.
Chemical Property Profile of N-({4-[acetyl(methyl)amino]phenyl}carbamothioyl)benzamide
Property Insights of N-({4-[acetyl(methyl)amino]phenyl}carbamothioyl)benzamide
The XLogP value of 2.7961 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-({4-[acetyl(methyl)amino]phenyl}carbamothioyl)benzamide. The TPSA of 61.44 Ų falls within the moderate polarity range, balancing permeability and solubility for N-({4-[acetyl(methyl)amino]phenyl}carbamothioyl)benzamide. Following Lipinski's Rule of Five, N-({4-[acetyl(methyl)amino]phenyl}carbamothioyl)benzamide 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-[acetyl(methyl)amino]phenyl}carbamothioyl)benzamide?
The CAS number of N-({4-[acetyl(methyl)amino]phenyl}carbamothioyl)benzamide is 496029-74-4.
What is the molecular formula of N-({4-[acetyl(methyl)amino]phenyl}carbamothioyl)benzamide?
The molecular formula of N-({4-[acetyl(methyl)amino]phenyl}carbamothioyl)benzamide is C17H17N3O2S.
What is the molecular weight of N-({4-[acetyl(methyl)amino]phenyl}carbamothioyl)benzamide?
The molecular weight of N-({4-[acetyl(methyl)amino]phenyl}carbamothioyl)benzamide is 327.10 g/mol.
Where can I buy N-({4-[acetyl(methyl)amino]phenyl}carbamothioyl)benzamide?
You can request a quote for N-({4-[acetyl(methyl)amino]phenyl}carbamothioyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-({4-[acetyl(methyl)amino]phenyl}carbamothioyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-({4-[acetyl(methyl)amino]phenyl}carbamothioyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.