Ethyl(phenyl)carbamothioyl chloride
TL;DR: Ethyl(phenyl)carbamothioyl chloride (CAS 35517-93-2) is a chemical compound with molecular formula C9H10ClNS and molecular weight 199.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-ethyl-N-phenylcarbamothioyl chloride
Also Known As: N-Ethyl-N-phenylthiocarbamoyl chloride, N-ethyl-N-phenylcarbamothioyl chloride, Ethyl(phenyl)carbamothioyl chloride, N-ethyl-N-phenyl-carbamothioyl chloride, Carbamothioic chloride,ethylphenyl- (9CI)
| Molecular Formula | C9H10ClNS |
|---|---|
| Molecular Weight | 199.02 g/mol |
| LogP | 3.0366 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 199.02225 |
| Heavy Atoms | 12 |
| Complexity | 260.49088 |
Chemical Identifiers
| CAS Number | 35517-93-2 |
|---|---|
| SMILES | CCN(C1=CC=CC=C1)C(=S)Cl |
Product Overview
Ethyl(phenyl)carbamothioyl chloride (CAS 35517-93-2), with molecular formula C9H10ClNS and molecular weight 199.02 g/mol. IUPAC: N-ethyl-N-phenylcarbamothioyl chloride.
Chemical Property Profile of Ethyl(phenyl)carbamothioyl chloride
Property Insights of Ethyl(phenyl)carbamothioyl chloride
The XLogP value of 3.0366 indicates that Ethyl(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, Ethyl(phenyl)carbamothioyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl(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 Ethyl(phenyl)carbamothioyl chloride?
The CAS number of Ethyl(phenyl)carbamothioyl chloride is 35517-93-2.
What is the molecular formula of Ethyl(phenyl)carbamothioyl chloride?
The molecular formula of Ethyl(phenyl)carbamothioyl chloride is C9H10ClNS.
What is the molecular weight of Ethyl(phenyl)carbamothioyl chloride?
The molecular weight of Ethyl(phenyl)carbamothioyl chloride is 199.02 g/mol.
Where can I buy Ethyl(phenyl)carbamothioyl chloride?
You can request a quote for Ethyl(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 Ethyl(phenyl)carbamothioyl chloride?
Yes, KEHONG BIO provides custom synthesis services for Ethyl(phenyl)carbamothioyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.