3-(3-Chlorophenyl)-1-methyl-1-phenylurea
TL;DR: 3-(3-Chlorophenyl)-1-methyl-1-phenylurea (CAS 77585-88-7) is a chemical compound with molecular formula C14H13ClN2O and molecular weight 260.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-chlorophenyl)-1-methyl-1-phenylurea
Also Known As: 3-(3-chlorophenyl)-1-methyl-1-phenylurea, Urea, N'-(3-chlorophenyl)-N-methyl-N-phenyl-, N'-(3-chlorophenyl)-N-methyl-N-phenylurea, N'-(3-Chlorophenyl)-N-methyl-N-phenylcarbamimidic acid, 667-219-7
| Molecular Formula | C14H13ClN2O |
|---|---|
| Molecular Weight | 260.07 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 260.07166 |
| Heavy Atoms | 18 |
| Complexity | 279.0 |
Chemical Identifiers
| CAS Number | 77585-88-7 |
|---|---|
| SMILES | CN(C1=CC=CC=C1)C(=O)NC2=CC(=CC=C2)Cl |
| InChIKey | PCRPPGNGWUROKM-UHFFFAOYSA-N |
Product Overview
3-(3-Chlorophenyl)-1-methyl-1-phenylurea (CAS 77585-88-7), with molecular formula C14H13ClN2O and molecular weight 260.07 g/mol. IUPAC: 3-(3-chlorophenyl)-1-methyl-1-phenylurea.
Chemical Property Profile of 3-(3-Chlorophenyl)-1-methyl-1-phenylurea
Property Insights of 3-(3-Chlorophenyl)-1-methyl-1-phenylurea
The XLogP value of 3.6 indicates that 3-(3-Chlorophenyl)-1-methyl-1-phenylurea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.3 Ų, 3-(3-Chlorophenyl)-1-methyl-1-phenylurea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3-Chlorophenyl)-1-methyl-1-phenylurea has 1 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 3-(3-Chlorophenyl)-1-methyl-1-phenylurea?
The CAS number of 3-(3-Chlorophenyl)-1-methyl-1-phenylurea is 77585-88-7.
What is the molecular formula of 3-(3-Chlorophenyl)-1-methyl-1-phenylurea?
The molecular formula of 3-(3-Chlorophenyl)-1-methyl-1-phenylurea is C14H13ClN2O.
What is the molecular weight of 3-(3-Chlorophenyl)-1-methyl-1-phenylurea?
The molecular weight of 3-(3-Chlorophenyl)-1-methyl-1-phenylurea is 260.07 g/mol.
Where can I buy 3-(3-Chlorophenyl)-1-methyl-1-phenylurea?
You can request a quote for 3-(3-Chlorophenyl)-1-methyl-1-phenylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-Chlorophenyl)-1-methyl-1-phenylurea?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-Chlorophenyl)-1-methyl-1-phenylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.