N-cyclohexyl-2-[(4-methylbenzoyl)carbamothioylamino]benzamide
TL;DR: N-cyclohexyl-2-[(4-methylbenzoyl)carbamothioylamino]benzamide (CAS 791793-38-9) is a chemical compound with molecular formula C22H25N3O2S and molecular weight 395.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-cyclohexyl-2-[(4-methylbenzoyl)carbamothioylamino]benzamide
Also Known As: AN-329/42613072, N-cyclohexyl-2-[(4-methylbenzoyl)carbamothioylamino]benzamide, N-cyclohexyl-2-({[(4-methylbenzoyl)amino]carbonothioyl}amino)benzamide, N-cyclohexyl-2-({[(4-methylbenzoyl)amino]carbothioyl}amino)benzamide, N-cyclohexyl-2-({[(4-methylphenyl)carbonyl]carbamothioyl}amino)benzamide
| Molecular Formula | C22H25N3O2S |
|---|---|
| Molecular Weight | 395.17 g/mol |
| LogP | 4.18432 |
| Topological Polar Surface Area | 70.23 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 395.16675 |
| Heavy Atoms | 28 |
| Complexity | 858.3405 |
Chemical Identifiers
| CAS Number | 791793-38-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NC3CCCCC3 |
Product Overview
N-cyclohexyl-2-[(4-methylbenzoyl)carbamothioylamino]benzamide (CAS 791793-38-9), with molecular formula C22H25N3O2S and molecular weight 395.17 g/mol. IUPAC: N-cyclohexyl-2-[(4-methylbenzoyl)carbamothioylamino]benzamide.
Chemical Property Profile of N-cyclohexyl-2-[(4-methylbenzoyl)carbamothioylamino]benzamide
Property Insights of N-cyclohexyl-2-[(4-methylbenzoyl)carbamothioylamino]benzamide
The XLogP value of 4.18432 indicates that N-cyclohexyl-2-[(4-methylbenzoyl)carbamothioylamino]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.23 Ų falls within the moderate polarity range, balancing permeability and solubility for N-cyclohexyl-2-[(4-methylbenzoyl)carbamothioylamino]benzamide. Following Lipinski's Rule of Five, N-cyclohexyl-2-[(4-methylbenzoyl)carbamothioylamino]benzamide 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 N-cyclohexyl-2-[(4-methylbenzoyl)carbamothioylamino]benzamide?
The CAS number of N-cyclohexyl-2-[(4-methylbenzoyl)carbamothioylamino]benzamide is 791793-38-9.
What is the molecular formula of N-cyclohexyl-2-[(4-methylbenzoyl)carbamothioylamino]benzamide?
The molecular formula of N-cyclohexyl-2-[(4-methylbenzoyl)carbamothioylamino]benzamide is C22H25N3O2S.
What is the molecular weight of N-cyclohexyl-2-[(4-methylbenzoyl)carbamothioylamino]benzamide?
The molecular weight of N-cyclohexyl-2-[(4-methylbenzoyl)carbamothioylamino]benzamide is 395.17 g/mol.
Where can I buy N-cyclohexyl-2-[(4-methylbenzoyl)carbamothioylamino]benzamide?
You can request a quote for N-cyclohexyl-2-[(4-methylbenzoyl)carbamothioylamino]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-cyclohexyl-2-[(4-methylbenzoyl)carbamothioylamino]benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-cyclohexyl-2-[(4-methylbenzoyl)carbamothioylamino]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.