1-(3-Chloro-4-methylphenyl)-3-methoxyurea
TL;DR: 1-(3-Chloro-4-methylphenyl)-3-methoxyurea (CAS 1239987-91-7) is a chemical compound with molecular formula C9H11ClN2O2 and molecular weight 214.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-chloro-4-methylphenyl)-3-methoxyurea
Also Known As: 1-(3-chloro-4-methylphenyl)-3-methoxyurea, Urea,N-(3-chlorophenyl)-N'-methoxy, N-(3-Chloro-4-methylphenyl)-N'-methoxyurea, (2E)-5-phenyl-1-(2-thienyl)-2-penten-1-one
| Molecular Formula | C9H11ClN2O2 |
|---|---|
| Molecular Weight | 214.05 g/mol |
| LogP | 2.33132 |
| Topological Polar Surface Area | 50.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 214.0509 |
| Heavy Atoms | 14 |
| Complexity | 341.5839 |
Chemical Identifiers
| CAS Number | 1239987-91-7 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)NOC)Cl |
Product Overview
1-(3-Chloro-4-methylphenyl)-3-methoxyurea (CAS 1239987-91-7), with molecular formula C9H11ClN2O2 and molecular weight 214.05 g/mol. IUPAC: 1-(3-chloro-4-methylphenyl)-3-methoxyurea.
Chemical Property Profile of 1-(3-Chloro-4-methylphenyl)-3-methoxyurea
Property Insights of 1-(3-Chloro-4-methylphenyl)-3-methoxyurea
The XLogP value of 2.33132 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-Chloro-4-methylphenyl)-3-methoxyurea. With a topological polar surface area (TPSA) of 50.36 Ų, 1-(3-Chloro-4-methylphenyl)-3-methoxyurea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Chloro-4-methylphenyl)-3-methoxyurea 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-4-methylphenyl)-3-methoxyurea?
The CAS number of 1-(3-Chloro-4-methylphenyl)-3-methoxyurea is 1239987-91-7.
What is the molecular formula of 1-(3-Chloro-4-methylphenyl)-3-methoxyurea?
The molecular formula of 1-(3-Chloro-4-methylphenyl)-3-methoxyurea is C9H11ClN2O2.
What is the molecular weight of 1-(3-Chloro-4-methylphenyl)-3-methoxyurea?
The molecular weight of 1-(3-Chloro-4-methylphenyl)-3-methoxyurea is 214.05 g/mol.
Where can I buy 1-(3-Chloro-4-methylphenyl)-3-methoxyurea?
You can request a quote for 1-(3-Chloro-4-methylphenyl)-3-methoxyurea 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-4-methylphenyl)-3-methoxyurea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Chloro-4-methylphenyl)-3-methoxyurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.