1-Benzyl-1,3-dimethylurea
TL;DR: 1-Benzyl-1,3-dimethylurea (CAS 59226-54-9) 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.
1-benzyl-1,3-dimethylurea
Also Known As: 1-benzyl-1,3-dimethylurea, Benzyldimethylurea, N-Benzyl-N,N'-dimethylurea, Urea,N,N'-dimethyl-N'-(phenylmethyl)-, Carbamimidothioic acid,N,N'-dimethyl-N-phenyl-,methyl ester
| Molecular Formula | C10H14N2O |
|---|---|
| Molecular Weight | 178.11 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 178.11061 |
| Heavy Atoms | 13 |
| Complexity | 164.0 |
Chemical Identifiers
| CAS Number | 59226-54-9 |
|---|---|
| SMILES | CNC(=O)N(C)CC1=CC=CC=C1 |
| InChIKey | FCKPKRLCONVQKG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Benzyl-1,3-dimethylurea (CAS 59226-54-9), with molecular formula C10H14N2O and molecular weight 178.11 g/mol. IUPAC: 1-benzyl-1,3-dimethylurea.
Chemical Property Profile of 1-Benzyl-1,3-dimethylurea
Property Insights of 1-Benzyl-1,3-dimethylurea
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Benzyl-1,3-dimethylurea. With a topological polar surface area (TPSA) of 32.3 Ų, 1-Benzyl-1,3-dimethylurea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzyl-1,3-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 1-Benzyl-1,3-dimethylurea?
The CAS number of 1-Benzyl-1,3-dimethylurea is 59226-54-9.
What is the molecular formula of 1-Benzyl-1,3-dimethylurea?
The molecular formula of 1-Benzyl-1,3-dimethylurea is C10H14N2O.
What is the molecular weight of 1-Benzyl-1,3-dimethylurea?
The molecular weight of 1-Benzyl-1,3-dimethylurea is 178.11 g/mol.
Where can I buy 1-Benzyl-1,3-dimethylurea?
You can request a quote for 1-Benzyl-1,3-dimethylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzyl-1,3-dimethylurea?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl-1,3-dimethylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.