1-(4-Chlorobenzyl)-3-(3,5-dimethylphenyl)thiourea
TL;DR: 1-(4-Chlorobenzyl)-3-(3,5-dimethylphenyl)thiourea (CAS 433320-12-8) is a chemical compound with molecular formula C16H17ClN2S and molecular weight 304.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-chlorophenyl)methyl]-3-(3,5-dimethylphenyl)thiourea
Also Known As: 1-(4-chlorobenzyl)-3-(3,5-dimethylphenyl)thiourea, AB01324966-02, 1-[(4-chlorophenyl)methyl]-3-(3,5-dimethylphenyl)thiourea, N-(4-CHLOROBENZYL)-N'-(3,5-DIMETHYLPHENYL)THIOUREA, [(3,5-dimethylphenyl)amino]{[(4-chlorophenyl)methyl]amino}methane-1-thione
| Molecular Formula | C16H17ClN2S |
|---|---|
| Molecular Weight | 304.08 g/mol |
| LogP | 4.44344 |
| Topological Polar Surface Area | 24.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 304.0801 |
| Heavy Atoms | 20 |
| Complexity | 588.12396 |
Chemical Identifiers
| CAS Number | 433320-12-8 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)NC(=S)NCC2=CC=C(C=C2)Cl)C |
Product Overview
1-(4-Chlorobenzyl)-3-(3,5-dimethylphenyl)thiourea (CAS 433320-12-8), with molecular formula C16H17ClN2S and molecular weight 304.08 g/mol. IUPAC: 1-[(4-chlorophenyl)methyl]-3-(3,5-dimethylphenyl)thiourea.
Chemical Property Profile of 1-(4-Chlorobenzyl)-3-(3,5-dimethylphenyl)thiourea
Property Insights of 1-(4-Chlorobenzyl)-3-(3,5-dimethylphenyl)thiourea
The XLogP value of 4.44344 indicates that 1-(4-Chlorobenzyl)-3-(3,5-dimethylphenyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.06 Ų, 1-(4-Chlorobenzyl)-3-(3,5-dimethylphenyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Chlorobenzyl)-3-(3,5-dimethylphenyl)thiourea 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 1-(4-Chlorobenzyl)-3-(3,5-dimethylphenyl)thiourea?
The CAS number of 1-(4-Chlorobenzyl)-3-(3,5-dimethylphenyl)thiourea is 433320-12-8.
What is the molecular formula of 1-(4-Chlorobenzyl)-3-(3,5-dimethylphenyl)thiourea?
The molecular formula of 1-(4-Chlorobenzyl)-3-(3,5-dimethylphenyl)thiourea is C16H17ClN2S.
What is the molecular weight of 1-(4-Chlorobenzyl)-3-(3,5-dimethylphenyl)thiourea?
The molecular weight of 1-(4-Chlorobenzyl)-3-(3,5-dimethylphenyl)thiourea is 304.08 g/mol.
Where can I buy 1-(4-Chlorobenzyl)-3-(3,5-dimethylphenyl)thiourea?
You can request a quote for 1-(4-Chlorobenzyl)-3-(3,5-dimethylphenyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Chlorobenzyl)-3-(3,5-dimethylphenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Chlorobenzyl)-3-(3,5-dimethylphenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.