N-(cyclohexylcarbamothioyl)-4-ethylbenzenesulfonamide
TL;DR: N-(cyclohexylcarbamothioyl)-4-ethylbenzenesulfonamide (CAS 54772-84-8) is a chemical compound with molecular formula C15H22N2O2S2 and molecular weight 326.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-cyclohexyl-3-(4-ethylphenyl)sulfonylthiourea
Also Known As: N-(cyclohexylcarbamothioyl)-4-ethylbenzenesulfonamide, 1-cyclohexyl-3-(4-ethylphenyl)sulfonylthiourea, 1-CYCLOHEXYL-3-(4-ETHYLBENZENESULFONYL)THIOUREA, 1-cyclohexyl-3-(4-ethylphenyl)sulfonyl-thiourea, N-[(cyclohexylamino)carbonothioyl]-4-ethylbenzenesulfonamide
| Molecular Formula | C15H22N2O2S2 |
|---|---|
| Molecular Weight | 326.11 g/mol |
| LogP | 2.7345 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 326.11227 |
| Heavy Atoms | 21 |
| Complexity | 576.1961 |
Chemical Identifiers
| CAS Number | 54772-84-8 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)S(=O)(=O)NC(=S)NC2CCCCC2 |
Product Overview
N-(cyclohexylcarbamothioyl)-4-ethylbenzenesulfonamide (CAS 54772-84-8), with molecular formula C15H22N2O2S2 and molecular weight 326.11 g/mol. IUPAC: 1-cyclohexyl-3-(4-ethylphenyl)sulfonylthiourea.
Chemical Property Profile of N-(cyclohexylcarbamothioyl)-4-ethylbenzenesulfonamide
Property Insights of N-(cyclohexylcarbamothioyl)-4-ethylbenzenesulfonamide
The XLogP value of 2.7345 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(cyclohexylcarbamothioyl)-4-ethylbenzenesulfonamide. With a topological polar surface area (TPSA) of 58.2 Ų, N-(cyclohexylcarbamothioyl)-4-ethylbenzenesulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(cyclohexylcarbamothioyl)-4-ethylbenzenesulfonamide 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-(cyclohexylcarbamothioyl)-4-ethylbenzenesulfonamide?
The CAS number of N-(cyclohexylcarbamothioyl)-4-ethylbenzenesulfonamide is 54772-84-8.
What is the molecular formula of N-(cyclohexylcarbamothioyl)-4-ethylbenzenesulfonamide?
The molecular formula of N-(cyclohexylcarbamothioyl)-4-ethylbenzenesulfonamide is C15H22N2O2S2.
What is the molecular weight of N-(cyclohexylcarbamothioyl)-4-ethylbenzenesulfonamide?
The molecular weight of N-(cyclohexylcarbamothioyl)-4-ethylbenzenesulfonamide is 326.11 g/mol.
Where can I buy N-(cyclohexylcarbamothioyl)-4-ethylbenzenesulfonamide?
You can request a quote for N-(cyclohexylcarbamothioyl)-4-ethylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(cyclohexylcarbamothioyl)-4-ethylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(cyclohexylcarbamothioyl)-4-ethylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.