Benzenecarbothioamide, N-(4-chlorophenyl)-4-methyl-
TL;DR: Benzenecarbothioamide, N-(4-chlorophenyl)-4-methyl- (CAS 101078-48-2) 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-(4-chlorophenyl)-4-methylbenzenecarbothioamide
Also Known As: Benzenecarbothioamide, N-(4-chlorophenyl)-4-methyl-, N-(4-chlorophenyl)-4-methylbenzenecarbothioamide, N-(4-Chlorophenyl)-4-methylthiobenzamide, Benzenecarbothioamide,N-(4-chlorophenyl)-4-methyl-, J1.248.147K
| Molecular Formula | C14H12ClNS |
|---|---|
| Molecular Weight | 261.04 g/mol |
| LogP | 4.43602 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 261.0379 |
| Heavy Atoms | 17 |
| Complexity | 516.9234 |
Chemical Identifiers
| CAS Number | 101078-48-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=S)NC2=CC=C(C=C2)Cl |
Product Overview
Benzenecarbothioamide, N-(4-chlorophenyl)-4-methyl- (CAS 101078-48-2), with molecular formula C14H12ClNS and molecular weight 261.04 g/mol. IUPAC: N-(4-chlorophenyl)-4-methylbenzenecarbothioamide.
Chemical Property Profile of Benzenecarbothioamide, N-(4-chlorophenyl)-4-methyl-
Property Insights of Benzenecarbothioamide, N-(4-chlorophenyl)-4-methyl-
The XLogP value of 4.43602 indicates that Benzenecarbothioamide, N-(4-chlorophenyl)-4-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.03 Ų, Benzenecarbothioamide, N-(4-chlorophenyl)-4-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenecarbothioamide, N-(4-chlorophenyl)-4-methyl- has 1 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 Benzenecarbothioamide, N-(4-chlorophenyl)-4-methyl-?
The CAS number of Benzenecarbothioamide, N-(4-chlorophenyl)-4-methyl- is 101078-48-2.
What is the molecular formula of Benzenecarbothioamide, N-(4-chlorophenyl)-4-methyl-?
The molecular formula of Benzenecarbothioamide, N-(4-chlorophenyl)-4-methyl- is C14H12ClNS.
What is the molecular weight of Benzenecarbothioamide, N-(4-chlorophenyl)-4-methyl-?
The molecular weight of Benzenecarbothioamide, N-(4-chlorophenyl)-4-methyl- is 261.04 g/mol.
Where can I buy Benzenecarbothioamide, N-(4-chlorophenyl)-4-methyl-?
You can request a quote for Benzenecarbothioamide, N-(4-chlorophenyl)-4-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenecarbothioamide, N-(4-chlorophenyl)-4-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Benzenecarbothioamide, N-(4-chlorophenyl)-4-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.