Methyl(phenyl)carbamothioyl chloride
TL;DR: Methyl(phenyl)carbamothioyl chloride (CAS 18880-36-9) is a chemical compound with molecular formula C8H8ClNS and molecular weight 185.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-N-phenylcarbamothioyl chloride
Also Known As: triprolidine, N-Methyl-N-phenylthiocarbamoyl chloride, N-methyl-N-phenylcarbamothioyl chloride, methyl(phenyl)carbamothioic chloride, Methyl(phenyl)carbamothioyl chloride
| Molecular Formula | C8H8ClNS |
|---|---|
| Molecular Weight | 185.01 g/mol |
| LogP | 2.6465 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 185.00659 |
| Heavy Atoms | 11 |
| Complexity | 247.5288 |
Chemical Identifiers
| CAS Number | 18880-36-9 |
|---|---|
| SMILES | CN(C1=CC=CC=C1)C(=S)Cl |
Product Overview
Methyl(phenyl)carbamothioyl chloride (CAS 18880-36-9), with molecular formula C8H8ClNS and molecular weight 185.01 g/mol. IUPAC: N-methyl-N-phenylcarbamothioyl chloride.
Chemical Property Profile of Methyl(phenyl)carbamothioyl chloride
Property Insights of Methyl(phenyl)carbamothioyl chloride
The XLogP value of 2.6465 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl(phenyl)carbamothioyl chloride. With a topological polar surface area (TPSA) of 3.24 Ų, Methyl(phenyl)carbamothioyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl(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 Methyl(phenyl)carbamothioyl chloride?
The CAS number of Methyl(phenyl)carbamothioyl chloride is 18880-36-9.
What is the molecular formula of Methyl(phenyl)carbamothioyl chloride?
The molecular formula of Methyl(phenyl)carbamothioyl chloride is C8H8ClNS.
What is the molecular weight of Methyl(phenyl)carbamothioyl chloride?
The molecular weight of Methyl(phenyl)carbamothioyl chloride is 185.01 g/mol.
Where can I buy Methyl(phenyl)carbamothioyl chloride?
You can request a quote for Methyl(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 Methyl(phenyl)carbamothioyl chloride?
Yes, KEHONG BIO provides custom synthesis services for Methyl(phenyl)carbamothioyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.