Urea, (3,4-dimethylbenzyl)-
TL;DR: Urea, (3,4-dimethylbenzyl)- (CAS 53663-37-9) is a chemical compound with molecular formula C10H14N2O and molecular weight 178.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,4-dimethylphenyl)methylurea
Also Known As: (3,4-Dimethylbenzyl)urea, Urea, (3,4-dimethylbenzyl)-, 1-(3,4-dimethylbenzyl)urea, (3,4-dimethylphenyl)methylurea, KST-1B5017
| Molecular Formula | C10H14N2O |
|---|---|
| Molecular Weight | 178.11 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 55.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 178.11061 |
| Heavy Atoms | 13 |
| Complexity | 182.0 |
Chemical Identifiers
| CAS Number | 53663-37-9 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)CNC(=O)N)C |
| InChIKey | GSIZYMUBKUGGNY-UHFFFAOYSA-N |
Product Overview
Urea, (3,4-dimethylbenzyl)- (CAS 53663-37-9), with molecular formula C10H14N2O and molecular weight 178.11 g/mol. IUPAC: (3,4-dimethylphenyl)methylurea.
Chemical Property Profile of Urea, (3,4-dimethylbenzyl)-
Property Insights of Urea, (3,4-dimethylbenzyl)-
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, (3,4-dimethylbenzyl)-. With a topological polar surface area (TPSA) of 55.1 Ų, Urea, (3,4-dimethylbenzyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Urea, (3,4-dimethylbenzyl)- 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, (3,4-dimethylbenzyl)-?
The CAS number of Urea, (3,4-dimethylbenzyl)- is 53663-37-9.
What is the molecular formula of Urea, (3,4-dimethylbenzyl)-?
The molecular formula of Urea, (3,4-dimethylbenzyl)- is C10H14N2O.
What is the molecular weight of Urea, (3,4-dimethylbenzyl)-?
The molecular weight of Urea, (3,4-dimethylbenzyl)- is 178.11 g/mol.
Where can I buy Urea, (3,4-dimethylbenzyl)-?
You can request a quote for Urea, (3,4-dimethylbenzyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, (3,4-dimethylbenzyl)-?
Yes, KEHONG BIO provides custom synthesis services for Urea, (3,4-dimethylbenzyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.