Urea, 1-(2-chloroethyl)-3-mesityl-
TL;DR: Urea, 1-(2-chloroethyl)-3-mesityl- (CAS 33021-67-9) is a chemical compound with molecular formula C12H17ClN2O and molecular weight 240.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-chloroethyl)-3-(2,4,6-trimethylphenyl)urea
Also Known As: 1-(2-Chloroethyl)-3-mesitylurea, Urea, 1-(2-chloroethyl)-3-mesityl-, NCIOpen2_006754, 1-(2-chloroethyl)-3-(2,4,6-trimethylphenyl)urea, Urea, N-(2-chloroethyl)-N'-(2,4,6-trimethylphenyl)-
| Molecular Formula | C12H17ClN2O |
|---|---|
| Molecular Weight | 240.10 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 41.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 240.10294 |
| Heavy Atoms | 16 |
| Complexity | 223.0 |
Chemical Identifiers
| CAS Number | 33021-67-9 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C)NC(=O)NCCCl)C |
| InChIKey | HEVQKTSFRAXZIU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Urea, 1-(2-chloroethyl)-3-mesityl- (CAS 33021-67-9), with molecular formula C12H17ClN2O and molecular weight 240.10 g/mol. IUPAC: 1-(2-chloroethyl)-3-(2,4,6-trimethylphenyl)urea.
Chemical Property Profile of Urea, 1-(2-chloroethyl)-3-mesityl-
Property Insights of Urea, 1-(2-chloroethyl)-3-mesityl-
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, 1-(2-chloroethyl)-3-mesityl-. With a topological polar surface area (TPSA) of 41.1 Ų, Urea, 1-(2-chloroethyl)-3-mesityl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Urea, 1-(2-chloroethyl)-3-mesityl- has 2 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 Urea, 1-(2-chloroethyl)-3-mesityl-?
The CAS number of Urea, 1-(2-chloroethyl)-3-mesityl- is 33021-67-9.
What is the molecular formula of Urea, 1-(2-chloroethyl)-3-mesityl-?
The molecular formula of Urea, 1-(2-chloroethyl)-3-mesityl- is C12H17ClN2O.
What is the molecular weight of Urea, 1-(2-chloroethyl)-3-mesityl-?
The molecular weight of Urea, 1-(2-chloroethyl)-3-mesityl- is 240.10 g/mol.
Where can I buy Urea, 1-(2-chloroethyl)-3-mesityl-?
You can request a quote for Urea, 1-(2-chloroethyl)-3-mesityl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, 1-(2-chloroethyl)-3-mesityl-?
Yes, KEHONG BIO provides custom synthesis services for Urea, 1-(2-chloroethyl)-3-mesityl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.