S-(4-chlorophenyl) N-phenylcarbamothioate
TL;DR: S-(4-chlorophenyl) N-phenylcarbamothioate (CAS 73207-58-6) is a chemical compound with molecular formula C13H10ClNOS and molecular weight 263.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-(4-chlorophenyl) N-phenylcarbamothioate
Also Known As: s-(4-chlorophenyl) phenylcarbamothioate, Carbanilic acid, p-chlorophenyl ester, S-(4-chlorophenyl) N-phenylcarbamothioate, Phenylthiocarbamic acid S-(4-chlorophenyl) ester, 1-[(4-chlorophenyl)sulfanyl]-N-phenylformamide
| Molecular Formula | C13H10ClNOS |
|---|---|
| Molecular Weight | 263.02 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 263.01715 |
| Heavy Atoms | 17 |
| Complexity | 248.0 |
Chemical Identifiers
| CAS Number | 73207-58-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=O)SC2=CC=C(C=C2)Cl |
| InChIKey | HFAKYDJGZZXQSU-UHFFFAOYSA-N |
Product Overview
S-(4-chlorophenyl) N-phenylcarbamothioate (CAS 73207-58-6), with molecular formula C13H10ClNOS and molecular weight 263.02 g/mol. IUPAC: S-(4-chlorophenyl) N-phenylcarbamothioate.
Chemical Property Profile of S-(4-chlorophenyl) N-phenylcarbamothioate
Property Insights of S-(4-chlorophenyl) N-phenylcarbamothioate
The XLogP value of 4.2 indicates that S-(4-chlorophenyl) N-phenylcarbamothioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.4 Ų, S-(4-chlorophenyl) N-phenylcarbamothioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, S-(4-chlorophenyl) N-phenylcarbamothioate has 1 hydrogen bond donor(s) and 2 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 S-(4-chlorophenyl) N-phenylcarbamothioate?
The CAS number of S-(4-chlorophenyl) N-phenylcarbamothioate is 73207-58-6.
What is the molecular formula of S-(4-chlorophenyl) N-phenylcarbamothioate?
The molecular formula of S-(4-chlorophenyl) N-phenylcarbamothioate is C13H10ClNOS.
What is the molecular weight of S-(4-chlorophenyl) N-phenylcarbamothioate?
The molecular weight of S-(4-chlorophenyl) N-phenylcarbamothioate is 263.02 g/mol.
Where can I buy S-(4-chlorophenyl) N-phenylcarbamothioate?
You can request a quote for S-(4-chlorophenyl) N-phenylcarbamothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-(4-chlorophenyl) N-phenylcarbamothioate?
Yes, KEHONG BIO provides custom synthesis services for S-(4-chlorophenyl) N-phenylcarbamothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.