3-(3-Chloro-2-methylphenyl)-1,1-dimethylurea
TL;DR: 3-(3-Chloro-2-methylphenyl)-1,1-dimethylurea (CAS 15441-91-5) is a chemical compound with molecular formula C10H13ClN2O and molecular weight 212.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-chloro-2-methylphenyl)-1,1-dimethylurea
Also Known As: 3-(3-chloro-2-methylphenyl)-1,1-dimethylurea, Urea, 3-(3-chloro-o-tolyl)-1,1-dimethyl-, 1-(3-chloro-2-methylphenyl)-3,3-dimethylurea, N'-(3-Chloro-2-methylphenyl)-N,N-dimethylurea, N'-(3-Chloro-2-methylphenyl)-N,N-dimethylurea #
| Molecular Formula | C10H13ClN2O |
|---|---|
| Molecular Weight | 212.07 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 212.07164 |
| Heavy Atoms | 14 |
| Complexity | 208.0 |
Chemical Identifiers
| CAS Number | 15441-91-5 |
|---|---|
| SMILES | CC1=C(C=CC=C1Cl)NC(=O)N(C)C |
| InChIKey | YSMGKTOVYFPIPS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(3-Chloro-2-methylphenyl)-1,1-dimethylurea (CAS 15441-91-5), with molecular formula C10H13ClN2O and molecular weight 212.07 g/mol. IUPAC: 3-(3-chloro-2-methylphenyl)-1,1-dimethylurea.
Chemical Property Profile of 3-(3-Chloro-2-methylphenyl)-1,1-dimethylurea
Property Insights of 3-(3-Chloro-2-methylphenyl)-1,1-dimethylurea
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3-Chloro-2-methylphenyl)-1,1-dimethylurea. With a topological polar surface area (TPSA) of 32.3 Ų, 3-(3-Chloro-2-methylphenyl)-1,1-dimethylurea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3-Chloro-2-methylphenyl)-1,1-dimethylurea 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-Chloro-2-methylphenyl)-1,1-dimethylurea?
The CAS number of 3-(3-Chloro-2-methylphenyl)-1,1-dimethylurea is 15441-91-5.
What is the molecular formula of 3-(3-Chloro-2-methylphenyl)-1,1-dimethylurea?
The molecular formula of 3-(3-Chloro-2-methylphenyl)-1,1-dimethylurea is C10H13ClN2O.
What is the molecular weight of 3-(3-Chloro-2-methylphenyl)-1,1-dimethylurea?
The molecular weight of 3-(3-Chloro-2-methylphenyl)-1,1-dimethylurea is 212.07 g/mol.
Where can I buy 3-(3-Chloro-2-methylphenyl)-1,1-dimethylurea?
You can request a quote for 3-(3-Chloro-2-methylphenyl)-1,1-dimethylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-Chloro-2-methylphenyl)-1,1-dimethylurea?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-Chloro-2-methylphenyl)-1,1-dimethylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.