N-(2-chlorobenzyl)-N'-cyclopentylthiourea
TL;DR: N-(2-chlorobenzyl)-N'-cyclopentylthiourea (CAS 664970-28-9) is a chemical compound with molecular formula C13H17ClN2S and molecular weight 268.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2-chlorophenyl)methyl]-3-cyclopentylthiourea
Also Known As: N-(2-chlorobenzyl)-N'-cyclopentylthiourea, 1-(2-chlorobenzyl)-3-cyclopentylthiourea, 1-[(2-chlorophenyl)methyl]-3-cyclopentylthiourea, N-(2-Chlorobenzyl)-N/'-cyclopentylthiourea, AJ-292/41694780
| Molecular Formula | C13H17ClN2S |
|---|---|
| Molecular Weight | 268.08 g/mol |
| LogP | 3.2467 |
| Topological Polar Surface Area | 24.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 268.0801 |
| Heavy Atoms | 17 |
| Complexity | 388.76077 |
Chemical Identifiers
| CAS Number | 664970-28-9 |
|---|---|
| SMILES | C1CCC(C1)NC(=S)NCC2=CC=CC=C2Cl |
Product Overview
N-(2-chlorobenzyl)-N'-cyclopentylthiourea (CAS 664970-28-9), with molecular formula C13H17ClN2S and molecular weight 268.08 g/mol. IUPAC: 1-[(2-chlorophenyl)methyl]-3-cyclopentylthiourea.
Chemical Property Profile of N-(2-chlorobenzyl)-N'-cyclopentylthiourea
Property Insights of N-(2-chlorobenzyl)-N'-cyclopentylthiourea
The XLogP value of 3.2467 indicates that N-(2-chlorobenzyl)-N'-cyclopentylthiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.06 Ų, N-(2-chlorobenzyl)-N'-cyclopentylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-chlorobenzyl)-N'-cyclopentylthiourea has 2 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 N-(2-chlorobenzyl)-N'-cyclopentylthiourea?
The CAS number of N-(2-chlorobenzyl)-N'-cyclopentylthiourea is 664970-28-9.
What is the molecular formula of N-(2-chlorobenzyl)-N'-cyclopentylthiourea?
The molecular formula of N-(2-chlorobenzyl)-N'-cyclopentylthiourea is C13H17ClN2S.
What is the molecular weight of N-(2-chlorobenzyl)-N'-cyclopentylthiourea?
The molecular weight of N-(2-chlorobenzyl)-N'-cyclopentylthiourea is 268.08 g/mol.
Where can I buy N-(2-chlorobenzyl)-N'-cyclopentylthiourea?
You can request a quote for N-(2-chlorobenzyl)-N'-cyclopentylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-chlorobenzyl)-N'-cyclopentylthiourea?
Yes, KEHONG BIO provides custom synthesis services for N-(2-chlorobenzyl)-N'-cyclopentylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.