S-Isopropyl N-(3,4-dichlorophenyl)thiolcarbamate
TL;DR: S-Isopropyl N-(3,4-dichlorophenyl)thiolcarbamate (CAS 10129-41-6) is a chemical compound with molecular formula C10H11Cl2NOS and molecular weight 262.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-propan-2-yl N-(3,4-dichlorophenyl)carbamothioate
Also Known As: S-propan-2-yl N-(3,4-dichlorophenyl)carbamothioate, (3,4-dichloro-phenyl)-thiocarbamic acid S-isopropyl ester, S-isopropyl 3,4-dichlorophenylthiocarbamate, 2-(2-HYDROXY-1-NAPHTHYL)ACETICACID, S-Isopropyl N-(3,4-dichlorophenyl)thiolcarbamate
| Molecular Formula | C10H11Cl2NOS |
|---|---|
| Molecular Weight | 262.99 g/mol |
| LogP | 4.6669 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 262.99384 |
| Heavy Atoms | 15 |
| Complexity | 368.44006 |
Chemical Identifiers
| CAS Number | 10129-41-6 |
|---|---|
| SMILES | CC(C)SC(=O)NC1=CC(=C(C=C1)Cl)Cl |
Product Overview
S-Isopropyl N-(3,4-dichlorophenyl)thiolcarbamate (CAS 10129-41-6), with molecular formula C10H11Cl2NOS and molecular weight 262.99 g/mol. IUPAC: S-propan-2-yl N-(3,4-dichlorophenyl)carbamothioate.
Chemical Property Profile of S-Isopropyl N-(3,4-dichlorophenyl)thiolcarbamate
Property Insights of S-Isopropyl N-(3,4-dichlorophenyl)thiolcarbamate
The XLogP value of 4.6669 indicates that S-Isopropyl N-(3,4-dichlorophenyl)thiolcarbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, S-Isopropyl N-(3,4-dichlorophenyl)thiolcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, S-Isopropyl N-(3,4-dichlorophenyl)thiolcarbamate 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-Isopropyl N-(3,4-dichlorophenyl)thiolcarbamate?
The CAS number of S-Isopropyl N-(3,4-dichlorophenyl)thiolcarbamate is 10129-41-6.
What is the molecular formula of S-Isopropyl N-(3,4-dichlorophenyl)thiolcarbamate?
The molecular formula of S-Isopropyl N-(3,4-dichlorophenyl)thiolcarbamate is C10H11Cl2NOS.
What is the molecular weight of S-Isopropyl N-(3,4-dichlorophenyl)thiolcarbamate?
The molecular weight of S-Isopropyl N-(3,4-dichlorophenyl)thiolcarbamate is 262.99 g/mol.
Where can I buy S-Isopropyl N-(3,4-dichlorophenyl)thiolcarbamate?
You can request a quote for S-Isopropyl N-(3,4-dichlorophenyl)thiolcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-Isopropyl N-(3,4-dichlorophenyl)thiolcarbamate?
Yes, KEHONG BIO provides custom synthesis services for S-Isopropyl N-(3,4-dichlorophenyl)thiolcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.