Benzyl(phenyl)carbamothioyl chloride
TL;DR: Benzyl(phenyl)carbamothioyl chloride (CAS 24053-61-0) is a chemical compound with molecular formula C14H12ClNS and molecular weight 261.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-N-phenylcarbamothioyl chloride
Also Known As: N-BENZYL-N-PHENYL-THIOCARBAMOYL CHLORIDE, N-benzyl-N-phenylcarbamothioyl chloride, Benzyl(phenyl)carbamothioyl chloride, Carbaniloyl chloride, N-benzylthio-(8CI), N-Benzyl-N-phenylthiocarbamoyl chloride
| Molecular Formula | C14H12ClNS |
|---|---|
| Molecular Weight | 261.04 g/mol |
| LogP | 4.2169 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 261.0379 |
| Heavy Atoms | 17 |
| Complexity | 484.0901 |
Chemical Identifiers
| CAS Number | 24053-61-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN(C2=CC=CC=C2)C(=S)Cl |
Product Overview
Benzyl(phenyl)carbamothioyl chloride (CAS 24053-61-0), with molecular formula C14H12ClNS and molecular weight 261.04 g/mol. IUPAC: N-benzyl-N-phenylcarbamothioyl chloride.
Chemical Property Profile of Benzyl(phenyl)carbamothioyl chloride
Property Insights of Benzyl(phenyl)carbamothioyl chloride
The XLogP value of 4.2169 indicates that Benzyl(phenyl)carbamothioyl chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.24 Ų, Benzyl(phenyl)carbamothioyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzyl(phenyl)carbamothioyl chloride has 0 hydrogen bond donor(s) and 1 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 Benzyl(phenyl)carbamothioyl chloride?
The CAS number of Benzyl(phenyl)carbamothioyl chloride is 24053-61-0.
What is the molecular formula of Benzyl(phenyl)carbamothioyl chloride?
The molecular formula of Benzyl(phenyl)carbamothioyl chloride is C14H12ClNS.
What is the molecular weight of Benzyl(phenyl)carbamothioyl chloride?
The molecular weight of Benzyl(phenyl)carbamothioyl chloride is 261.04 g/mol.
Where can I buy Benzyl(phenyl)carbamothioyl chloride?
You can request a quote for Benzyl(phenyl)carbamothioyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl(phenyl)carbamothioyl chloride?
Yes, KEHONG BIO provides custom synthesis services for Benzyl(phenyl)carbamothioyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.