3-(Phenylsulfamoyl)benzenecarbothioamide
TL;DR: 3-(Phenylsulfamoyl)benzenecarbothioamide (CAS 56542-71-3) is a chemical compound with molecular formula C13H12N2O2S2 and molecular weight 292.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(phenylsulfamoyl)benzenecarbothioamide
Also Known As: 3-(phenylsulfamoyl)benzenecarbothioamide, 3-(Phenylsulfamoyl)benzene-1-carbothioamide, RefChem:275837
| Molecular Formula | C13H12N2O2S2 |
|---|---|
| Molecular Weight | 292.03 g/mol |
| LogP | 2.1216 |
| Topological Polar Surface Area | 72.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 292.03403 |
| Heavy Atoms | 19 |
| Complexity | 697.59296 |
Chemical Identifiers
| CAS Number | 56542-71-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=S)N |
Product Overview
3-(Phenylsulfamoyl)benzenecarbothioamide (CAS 56542-71-3), with molecular formula C13H12N2O2S2 and molecular weight 292.03 g/mol. IUPAC: 3-(phenylsulfamoyl)benzenecarbothioamide.
Chemical Property Profile of 3-(Phenylsulfamoyl)benzenecarbothioamide
Property Insights of 3-(Phenylsulfamoyl)benzenecarbothioamide
The XLogP value of 2.1216 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Phenylsulfamoyl)benzenecarbothioamide. The TPSA of 72.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Phenylsulfamoyl)benzenecarbothioamide. Following Lipinski's Rule of Five, 3-(Phenylsulfamoyl)benzenecarbothioamide 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 3-(Phenylsulfamoyl)benzenecarbothioamide?
The CAS number of 3-(Phenylsulfamoyl)benzenecarbothioamide is 56542-71-3.
What is the molecular formula of 3-(Phenylsulfamoyl)benzenecarbothioamide?
The molecular formula of 3-(Phenylsulfamoyl)benzenecarbothioamide is C13H12N2O2S2.
What is the molecular weight of 3-(Phenylsulfamoyl)benzenecarbothioamide?
The molecular weight of 3-(Phenylsulfamoyl)benzenecarbothioamide is 292.03 g/mol.
Where can I buy 3-(Phenylsulfamoyl)benzenecarbothioamide?
You can request a quote for 3-(Phenylsulfamoyl)benzenecarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Phenylsulfamoyl)benzenecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(Phenylsulfamoyl)benzenecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.