Pseudourea, 2-(2-chlorobenzyl)-2-thio-, hydrochloride
TL;DR: Pseudourea, 2-(2-chlorobenzyl)-2-thio-, hydrochloride (CAS 14122-38-4) is a chemical compound with molecular formula C8H10Cl2N2S and molecular weight 235.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-chlorophenyl)methyl carbamimidothioate;hydrochloride
Also Known As: Pseudourea, hydrochloride, 2-chlorobenzyl imidothiocarbamate hydrochloride, Pseudourea, 2-(2-chlorobenzyl)-2-thio-, hydrochloride, 2-chlorobenzyl imidothiocarbamate, 2-Chlorobenzyl carbamimidothioate hydrochloride
| Molecular Formula | C8H10Cl2N2S |
|---|---|
| Molecular Weight | 235.99 g/mol |
| LogP | 2.88847 |
| Topological Polar Surface Area | 75.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 235.99417 |
| Heavy Atoms | 13 |
| Complexity | 163.0 |
Chemical Identifiers
| CAS Number | 14122-38-4 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CSC(=N)N)Cl.Cl |
| InChIKey | CEICVYXCGHTEIT-UHFFFAOYSA-N |
Product Overview
Pseudourea, 2-(2-chlorobenzyl)-2-thio-, hydrochloride (CAS 14122-38-4), with molecular formula C8H10Cl2N2S and molecular weight 235.99 g/mol. IUPAC: (2-chlorophenyl)methyl carbamimidothioate;hydrochloride.
Chemical Property Profile of Pseudourea, 2-(2-chlorobenzyl)-2-thio-, hydrochloride
Property Insights of Pseudourea, 2-(2-chlorobenzyl)-2-thio-, hydrochloride
The XLogP value of 2.88847 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pseudourea, 2-(2-chlorobenzyl)-2-thio-, hydrochloride. The TPSA of 75.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Pseudourea, 2-(2-chlorobenzyl)-2-thio-, hydrochloride. Following Lipinski's Rule of Five, Pseudourea, 2-(2-chlorobenzyl)-2-thio-, hydrochloride has 3 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 Pseudourea, 2-(2-chlorobenzyl)-2-thio-, hydrochloride?
The CAS number of Pseudourea, 2-(2-chlorobenzyl)-2-thio-, hydrochloride is 14122-38-4.
What is the molecular formula of Pseudourea, 2-(2-chlorobenzyl)-2-thio-, hydrochloride?
The molecular formula of Pseudourea, 2-(2-chlorobenzyl)-2-thio-, hydrochloride is C8H10Cl2N2S.
What is the molecular weight of Pseudourea, 2-(2-chlorobenzyl)-2-thio-, hydrochloride?
The molecular weight of Pseudourea, 2-(2-chlorobenzyl)-2-thio-, hydrochloride is 235.99 g/mol.
Where can I buy Pseudourea, 2-(2-chlorobenzyl)-2-thio-, hydrochloride?
You can request a quote for Pseudourea, 2-(2-chlorobenzyl)-2-thio-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pseudourea, 2-(2-chlorobenzyl)-2-thio-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Pseudourea, 2-(2-chlorobenzyl)-2-thio-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.