(3,4-dichlorophenyl)methyl N-(3,4-difluorophenyl)carbamodithioate
TL;DR: (3,4-dichlorophenyl)methyl N-(3,4-difluorophenyl)carbamodithioate (CAS 69243-69-2) is a chemical compound with molecular formula C14H9Cl2F2NS2 and molecular weight 362.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,4-dichlorophenyl)methyl N-(3,4-difluorophenyl)carbamodithioate
Also Known As: Carbamodithioic acid der., (3,4-dichlorophenyl)methyl N-(3,4-difluorophenyl)carbamodithioate, 3,4-Dichlorobenzyl (3,4-difluorophenyl)dithiocarbamate, (3,4-dichlorophenyl)methyl N-(3,4-difluorophenyl)carbamodith, (3,4-Dichlorophenyl)methyl (3,4-difluorophenyl)carbamodithioate
| Molecular Formula | C14H9Cl2F2NS2 |
|---|---|
| Molecular Weight | 362.95 g/mol |
| LogP | 5.9018 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 362.95215 |
| Heavy Atoms | 21 |
| Complexity | 680.01874 |
Chemical Identifiers
| CAS Number | 69243-69-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1CSC(=S)NC2=CC(=C(C=C2)F)F)Cl)Cl |
Product Overview
(3,4-dichlorophenyl)methyl N-(3,4-difluorophenyl)carbamodithioate (CAS 69243-69-2), with molecular formula C14H9Cl2F2NS2 and molecular weight 362.95 g/mol. IUPAC: (3,4-dichlorophenyl)methyl N-(3,4-difluorophenyl)carbamodithioate.
Chemical Property Profile of (3,4-dichlorophenyl)methyl N-(3,4-difluorophenyl)carbamodithioate
Property Insights of (3,4-dichlorophenyl)methyl N-(3,4-difluorophenyl)carbamodithioate
The XLogP value of 5.9018 indicates that (3,4-dichlorophenyl)methyl N-(3,4-difluorophenyl)carbamodithioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.03 Ų, (3,4-dichlorophenyl)methyl N-(3,4-difluorophenyl)carbamodithioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3,4-dichlorophenyl)methyl N-(3,4-difluorophenyl)carbamodithioate has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (3,4-dichlorophenyl)methyl N-(3,4-difluorophenyl)carbamodithioate?
The CAS number of (3,4-dichlorophenyl)methyl N-(3,4-difluorophenyl)carbamodithioate is 69243-69-2.
What is the molecular formula of (3,4-dichlorophenyl)methyl N-(3,4-difluorophenyl)carbamodithioate?
The molecular formula of (3,4-dichlorophenyl)methyl N-(3,4-difluorophenyl)carbamodithioate is C14H9Cl2F2NS2.
What is the molecular weight of (3,4-dichlorophenyl)methyl N-(3,4-difluorophenyl)carbamodithioate?
The molecular weight of (3,4-dichlorophenyl)methyl N-(3,4-difluorophenyl)carbamodithioate is 362.95 g/mol.
Where can I buy (3,4-dichlorophenyl)methyl N-(3,4-difluorophenyl)carbamodithioate?
You can request a quote for (3,4-dichlorophenyl)methyl N-(3,4-difluorophenyl)carbamodithioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3,4-dichlorophenyl)methyl N-(3,4-difluorophenyl)carbamodithioate?
Yes, KEHONG BIO provides custom synthesis services for (3,4-dichlorophenyl)methyl N-(3,4-difluorophenyl)carbamodithioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.