1-(3-Chloro-2-methylphenyl)-3-(3-methoxybenzyl)thiourea
TL;DR: 1-(3-Chloro-2-methylphenyl)-3-(3-methoxybenzyl)thiourea (CAS 516459-20-4) is a chemical compound with molecular formula C16H17ClN2OS and molecular weight 320.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-chloro-2-methylphenyl)-3-[(3-methoxyphenyl)methyl]thiourea
Also Known As: 1-(3-chloro-2-methylphenyl)-3-(3-methoxybenzyl)thiourea, 1-(3-chloro-2-methylphenyl)-3-[(3-methoxyphenyl)methyl]thiourea, N-(3-CHLORO-2-METHYLPHENYL)-N'-(3-METHOXYBENZYL)THIOUREA, [(3-chloro-2-methylphenyl)amino]{[(3-methoxyphenyl)methyl]amino}methane-1-thio ne
| Molecular Formula | C16H17ClN2OS |
|---|---|
| Molecular Weight | 320.07 g/mol |
| LogP | 4.14362 |
| Topological Polar Surface Area | 33.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 320.075 |
| Heavy Atoms | 21 |
| Complexity | 645.92413 |
Chemical Identifiers
| CAS Number | 516459-20-4 |
|---|---|
| SMILES | CC1=C(C=CC=C1Cl)NC(=S)NCC2=CC(=CC=C2)OC |
Product Overview
1-(3-Chloro-2-methylphenyl)-3-(3-methoxybenzyl)thiourea (CAS 516459-20-4), with molecular formula C16H17ClN2OS and molecular weight 320.07 g/mol. IUPAC: 1-(3-chloro-2-methylphenyl)-3-[(3-methoxyphenyl)methyl]thiourea.
Chemical Property Profile of 1-(3-Chloro-2-methylphenyl)-3-(3-methoxybenzyl)thiourea
Property Insights of 1-(3-Chloro-2-methylphenyl)-3-(3-methoxybenzyl)thiourea
The XLogP value of 4.14362 indicates that 1-(3-Chloro-2-methylphenyl)-3-(3-methoxybenzyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.29 Ų, 1-(3-Chloro-2-methylphenyl)-3-(3-methoxybenzyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Chloro-2-methylphenyl)-3-(3-methoxybenzyl)thiourea has 2 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 1-(3-Chloro-2-methylphenyl)-3-(3-methoxybenzyl)thiourea?
The CAS number of 1-(3-Chloro-2-methylphenyl)-3-(3-methoxybenzyl)thiourea is 516459-20-4.
What is the molecular formula of 1-(3-Chloro-2-methylphenyl)-3-(3-methoxybenzyl)thiourea?
The molecular formula of 1-(3-Chloro-2-methylphenyl)-3-(3-methoxybenzyl)thiourea is C16H17ClN2OS.
What is the molecular weight of 1-(3-Chloro-2-methylphenyl)-3-(3-methoxybenzyl)thiourea?
The molecular weight of 1-(3-Chloro-2-methylphenyl)-3-(3-methoxybenzyl)thiourea is 320.07 g/mol.
Where can I buy 1-(3-Chloro-2-methylphenyl)-3-(3-methoxybenzyl)thiourea?
You can request a quote for 1-(3-Chloro-2-methylphenyl)-3-(3-methoxybenzyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Chloro-2-methylphenyl)-3-(3-methoxybenzyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Chloro-2-methylphenyl)-3-(3-methoxybenzyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.