1-(3-Chloro-2-methylphenyl)-3-(3,4-dimethoxyphenyl)urea
TL;DR: 1-(3-Chloro-2-methylphenyl)-3-(3,4-dimethoxyphenyl)urea (CAS 899587-48-5) is a chemical compound with molecular formula C16H17ClN2O3 and molecular weight 320.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-chloro-2-methylphenyl)-3-(3,4-dimethoxyphenyl)urea
Also Known As: 1-(3-chloro-2-methylphenyl)-3-(3,4-dimethoxyphenyl)urea, N-(3-CHLORO-2-METHYLPHENYL)-N'-(3,4-DIMETHOXYPHENYL)UREA, [(3,4-dimethoxyphenyl)amino]-N-(3-chloro-2-methylphenyl)carboxamide
| Molecular Formula | C16H17ClN2O3 |
|---|---|
| Molecular Weight | 320.09 g/mol |
| LogP | 4.30962 |
| Topological Polar Surface Area | 59.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 320.09277 |
| Heavy Atoms | 22 |
| Complexity | 689.0863 |
Chemical Identifiers
| CAS Number | 899587-48-5 |
|---|---|
| SMILES | CC1=C(C=CC=C1Cl)NC(=O)NC2=CC(=C(C=C2)OC)OC |
Product Overview
1-(3-Chloro-2-methylphenyl)-3-(3,4-dimethoxyphenyl)urea (CAS 899587-48-5), with molecular formula C16H17ClN2O3 and molecular weight 320.09 g/mol. IUPAC: 1-(3-chloro-2-methylphenyl)-3-(3,4-dimethoxyphenyl)urea.
Chemical Property Profile of 1-(3-Chloro-2-methylphenyl)-3-(3,4-dimethoxyphenyl)urea
Property Insights of 1-(3-Chloro-2-methylphenyl)-3-(3,4-dimethoxyphenyl)urea
The XLogP value of 4.30962 indicates that 1-(3-Chloro-2-methylphenyl)-3-(3,4-dimethoxyphenyl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.59 Ų, 1-(3-Chloro-2-methylphenyl)-3-(3,4-dimethoxyphenyl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Chloro-2-methylphenyl)-3-(3,4-dimethoxyphenyl)urea has 2 hydrogen bond donor(s) and 3 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-(3,4-dimethoxyphenyl)urea?
The CAS number of 1-(3-Chloro-2-methylphenyl)-3-(3,4-dimethoxyphenyl)urea is 899587-48-5.
What is the molecular formula of 1-(3-Chloro-2-methylphenyl)-3-(3,4-dimethoxyphenyl)urea?
The molecular formula of 1-(3-Chloro-2-methylphenyl)-3-(3,4-dimethoxyphenyl)urea is C16H17ClN2O3.
What is the molecular weight of 1-(3-Chloro-2-methylphenyl)-3-(3,4-dimethoxyphenyl)urea?
The molecular weight of 1-(3-Chloro-2-methylphenyl)-3-(3,4-dimethoxyphenyl)urea is 320.09 g/mol.
Where can I buy 1-(3-Chloro-2-methylphenyl)-3-(3,4-dimethoxyphenyl)urea?
You can request a quote for 1-(3-Chloro-2-methylphenyl)-3-(3,4-dimethoxyphenyl)urea 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-(3,4-dimethoxyphenyl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Chloro-2-methylphenyl)-3-(3,4-dimethoxyphenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.