N-(cyclohexylcarbamothioyl)benzenesulfonamide
TL;DR: N-(cyclohexylcarbamothioyl)benzenesulfonamide (CAS 87486-62-2) is a chemical compound with molecular formula C13H18N2O2S2 and molecular weight 298.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(benzenesulfonyl)-3-cyclohexylthiourea
Also Known As: 1-(benzenesulfonyl)-3-cyclohexylthiourea, N-(cyclohexylcarbamothioyl)benzenesulfonamide, 1-besyl-3-cyclohexyl-thiourea, 1-cyclohexyl-3-(phenylsulfonyl)thiourea, Benzenesulfonamide, N-[(cyclohexylamino)thioxomethyl]-
| Molecular Formula | C13H18N2O2S2 |
|---|---|
| Molecular Weight | 298.08 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 98.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 298.08096 |
| Heavy Atoms | 19 |
| Complexity | 391.0 |
Chemical Identifiers
| CAS Number | 87486-62-2 |
|---|---|
| SMILES | C1CCC(CC1)NC(=S)NS(=O)(=O)C2=CC=CC=C2 |
| InChIKey | KXTQOXUYGWFXGV-UHFFFAOYSA-N |
Product Overview
N-(cyclohexylcarbamothioyl)benzenesulfonamide (CAS 87486-62-2), with molecular formula C13H18N2O2S2 and molecular weight 298.08 g/mol. IUPAC: 1-(benzenesulfonyl)-3-cyclohexylthiourea.
Chemical Property Profile of N-(cyclohexylcarbamothioyl)benzenesulfonamide
Property Insights of N-(cyclohexylcarbamothioyl)benzenesulfonamide
The XLogP value of 3.4 indicates that N-(cyclohexylcarbamothioyl)benzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(cyclohexylcarbamothioyl)benzenesulfonamide. Following Lipinski's Rule of Five, 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 N-(cyclohexylcarbamothioyl)benzenesulfonamide?
The CAS number of N-(cyclohexylcarbamothioyl)benzenesulfonamide is 87486-62-2.
What is the molecular formula of N-(cyclohexylcarbamothioyl)benzenesulfonamide?
The molecular formula of N-(cyclohexylcarbamothioyl)benzenesulfonamide is C13H18N2O2S2.
What is the molecular weight of N-(cyclohexylcarbamothioyl)benzenesulfonamide?
The molecular weight of N-(cyclohexylcarbamothioyl)benzenesulfonamide is 298.08 g/mol.
Where can I buy N-(cyclohexylcarbamothioyl)benzenesulfonamide?
You can request a quote for 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 N-(cyclohexylcarbamothioyl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(cyclohexylcarbamothioyl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.