4-bromo-N-(cyclohexylcarbamothioyl)benzenesulfonamide
TL;DR: 4-bromo-N-(cyclohexylcarbamothioyl)benzenesulfonamide (CAS 708993-39-9) is a chemical compound with molecular formula C13H17BrN2O2S2 and molecular weight 375.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-bromophenyl)sulfonyl-3-cyclohexylthiourea
Also Known As: 1-brosyl-3-cyclohexyl-thiourea, 4-bromo-N-(cyclohexylcarbamothioyl)benzenesulfonamide, 1-(4-bromophenyl)sulfonyl-3-cyclohexylthiourea, 1-(4-bromophenyl)sulfonyl-3-cyclohexyl-thiourea, 3-(4-BROMOBENZENESULFONYL)-1-CYCLOHEXYLTHIOUREA
| Molecular Formula | C13H17BrN2O2S2 |
|---|---|
| Molecular Weight | 375.99 g/mol |
| LogP | 2.9346 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 375.9915 |
| Heavy Atoms | 20 |
| Complexity | 566.5389 |
Chemical Identifiers
| CAS Number | 708993-39-9 |
|---|---|
| SMILES | C1CCC(CC1)NC(=S)NS(=O)(=O)C2=CC=C(C=C2)Br |
Product Overview
4-bromo-N-(cyclohexylcarbamothioyl)benzenesulfonamide (CAS 708993-39-9), with molecular formula C13H17BrN2O2S2 and molecular weight 375.99 g/mol. IUPAC: 1-(4-bromophenyl)sulfonyl-3-cyclohexylthiourea.
Chemical Property Profile of 4-bromo-N-(cyclohexylcarbamothioyl)benzenesulfonamide
Property Insights of 4-bromo-N-(cyclohexylcarbamothioyl)benzenesulfonamide
The XLogP value of 2.9346 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-bromo-N-(cyclohexylcarbamothioyl)benzenesulfonamide. With a topological polar surface area (TPSA) of 58.2 Ų, 4-bromo-N-(cyclohexylcarbamothioyl)benzenesulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-bromo-N-(cyclohexylcarbamothioyl)benzenesulfonamide 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 4-bromo-N-(cyclohexylcarbamothioyl)benzenesulfonamide?
The CAS number of 4-bromo-N-(cyclohexylcarbamothioyl)benzenesulfonamide is 708993-39-9.
What is the molecular formula of 4-bromo-N-(cyclohexylcarbamothioyl)benzenesulfonamide?
The molecular formula of 4-bromo-N-(cyclohexylcarbamothioyl)benzenesulfonamide is C13H17BrN2O2S2.
What is the molecular weight of 4-bromo-N-(cyclohexylcarbamothioyl)benzenesulfonamide?
The molecular weight of 4-bromo-N-(cyclohexylcarbamothioyl)benzenesulfonamide is 375.99 g/mol.
Where can I buy 4-bromo-N-(cyclohexylcarbamothioyl)benzenesulfonamide?
You can request a quote for 4-bromo-N-(cyclohexylcarbamothioyl)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-bromo-N-(cyclohexylcarbamothioyl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-bromo-N-(cyclohexylcarbamothioyl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.