3-(Propylsulfamoyl)benzenecarbothioamide
TL;DR: 3-(Propylsulfamoyl)benzenecarbothioamide (CAS 56542-70-2) is a chemical compound with molecular formula C10H14N2O2S2 and molecular weight 258.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(propylsulfamoyl)benzenecarbothioamide
Also Known As: 3-(propylsulfamoyl)benzenecarbothioamide, m-n-Propylsulfamoyl-thiobenzamid, 3-(Propylsulfamoyl)benzene-1-carbothioamide, RefChem:275927
| Molecular Formula | C10H14N2O2S2 |
|---|---|
| Molecular Weight | 258.05 g/mol |
| LogP | 1.0091 |
| Topological Polar Surface Area | 72.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 258.04968 |
| Heavy Atoms | 16 |
| Complexity | 483.34732 |
Chemical Identifiers
| CAS Number | 56542-70-2 |
|---|---|
| SMILES | CCCNS(=O)(=O)C1=CC=CC(=C1)C(=S)N |
Product Overview
3-(Propylsulfamoyl)benzenecarbothioamide (CAS 56542-70-2), with molecular formula C10H14N2O2S2 and molecular weight 258.05 g/mol. IUPAC: 3-(propylsulfamoyl)benzenecarbothioamide.
Chemical Property Profile of 3-(Propylsulfamoyl)benzenecarbothioamide
Property Insights of 3-(Propylsulfamoyl)benzenecarbothioamide
The XLogP value of 1.0091 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Propylsulfamoyl)benzenecarbothioamide. The TPSA of 72.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Propylsulfamoyl)benzenecarbothioamide. Following Lipinski's Rule of Five, 3-(Propylsulfamoyl)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-(Propylsulfamoyl)benzenecarbothioamide?
The CAS number of 3-(Propylsulfamoyl)benzenecarbothioamide is 56542-70-2.
What is the molecular formula of 3-(Propylsulfamoyl)benzenecarbothioamide?
The molecular formula of 3-(Propylsulfamoyl)benzenecarbothioamide is C10H14N2O2S2.
What is the molecular weight of 3-(Propylsulfamoyl)benzenecarbothioamide?
The molecular weight of 3-(Propylsulfamoyl)benzenecarbothioamide is 258.05 g/mol.
Where can I buy 3-(Propylsulfamoyl)benzenecarbothioamide?
You can request a quote for 3-(Propylsulfamoyl)benzenecarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Propylsulfamoyl)benzenecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(Propylsulfamoyl)benzenecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.