![4-[(anilinocarbothioyl)amino]-N-(2-phenylethyl)benzenesulfonamide structure](/static/products/6512/651296-75-2.webp)
4-[(anilinocarbothioyl)amino]-N-(2-phenylethyl)benzenesulfonamide
TL;DR: 4-[(anilinocarbothioyl)amino]-N-(2-phenylethyl)benzenesulfonamide (CAS 651296-75-2) is a chemical compound with molecular formula C21H21N3O2S2 and molecular weight 411.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyl-3-[4-(2-phenylethylsulfamoyl)phenyl]thiourea
Also Known As: 1-[4-(phenethylsulfamoyl)phenyl]-3-phenylthiourea, 1-phenyl-3-[4-(2-phenylethylsulfamoyl)phenyl]thiourea, AN-329/42158872, 4-[(anilinocarbothioyl)amino]-N-(2-phenylethyl)benzenesulfonamide, 4-[(anilinocarbonothioyl)amino]-N-(2-phenylethyl)benzenesulfonamide
| Molecular Formula | C21H21N3O2S2 |
|---|---|
| Molecular Weight | 411.11 g/mol |
| LogP | 4.0165 |
| Topological Polar Surface Area | 70.23 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 411.1075 |
| Heavy Atoms | 28 |
| Complexity | 1006.53595 |
Chemical Identifiers
| CAS Number | 651296-75-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCNS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CC=CC=C3 |
Product Overview
4-[(anilinocarbothioyl)amino]-N-(2-phenylethyl)benzenesulfonamide (CAS 651296-75-2), with molecular formula C21H21N3O2S2 and molecular weight 411.11 g/mol. IUPAC: 1-phenyl-3-[4-(2-phenylethylsulfamoyl)phenyl]thiourea.
Chemical Property Profile of 4-[(anilinocarbothioyl)amino]-N-(2-phenylethyl)benzenesulfonamide
Property Insights of 4-[(anilinocarbothioyl)amino]-N-(2-phenylethyl)benzenesulfonamide
The XLogP value of 4.0165 indicates that 4-[(anilinocarbothioyl)amino]-N-(2-phenylethyl)benzenesulfonamide 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 4-[(anilinocarbothioyl)amino]-N-(2-phenylethyl)benzenesulfonamide. Following Lipinski's Rule of Five, 4-[(anilinocarbothioyl)amino]-N-(2-phenylethyl)benzenesulfonamide 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 4-[(anilinocarbothioyl)amino]-N-(2-phenylethyl)benzenesulfonamide?
The CAS number of 4-[(anilinocarbothioyl)amino]-N-(2-phenylethyl)benzenesulfonamide is 651296-75-2.
What is the molecular formula of 4-[(anilinocarbothioyl)amino]-N-(2-phenylethyl)benzenesulfonamide?
The molecular formula of 4-[(anilinocarbothioyl)amino]-N-(2-phenylethyl)benzenesulfonamide is C21H21N3O2S2.
What is the molecular weight of 4-[(anilinocarbothioyl)amino]-N-(2-phenylethyl)benzenesulfonamide?
The molecular weight of 4-[(anilinocarbothioyl)amino]-N-(2-phenylethyl)benzenesulfonamide is 411.11 g/mol.
Where can I buy 4-[(anilinocarbothioyl)amino]-N-(2-phenylethyl)benzenesulfonamide?
You can request a quote for 4-[(anilinocarbothioyl)amino]-N-(2-phenylethyl)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(anilinocarbothioyl)amino]-N-(2-phenylethyl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-[(anilinocarbothioyl)amino]-N-(2-phenylethyl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.