alpha-(N-1-phenethyl)urea
TL;DR: alpha-(N-1-phenethyl)urea (CAS 16849-91-5) is a chemical compound with molecular formula C9H12N2O and molecular weight 164.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenylethylurea
Also Known As: (1-phenylethyl)urea, 1-Phenylethylurea, N-(1-phenylethyl)urea, 1-(1-Phenylethyl)urea, 1-phenethyl urea
| Molecular Formula | C9H12N2O |
|---|---|
| Molecular Weight | 164.09 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 55.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 164.09496 |
| Heavy Atoms | 12 |
| Complexity | 153.0 |
Chemical Identifiers
| CAS Number | 16849-91-5 |
|---|---|
| SMILES | CC(C1=CC=CC=C1)NC(=O)N |
| InChIKey | ALVBVEKNACPPAB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
alpha-(N-1-phenethyl)urea (CAS 16849-91-5), with molecular formula C9H12N2O and molecular weight 164.09 g/mol. IUPAC: 1-phenylethylurea.
Chemical Property Profile of alpha-(N-1-phenethyl)urea
Property Insights of alpha-(N-1-phenethyl)urea
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for alpha-(N-1-phenethyl)urea. With a topological polar surface area (TPSA) of 55.1 Ų, alpha-(N-1-phenethyl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha-(N-1-phenethyl)urea 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 alpha-(N-1-phenethyl)urea?
The CAS number of alpha-(N-1-phenethyl)urea is 16849-91-5.
What is the molecular formula of alpha-(N-1-phenethyl)urea?
The molecular formula of alpha-(N-1-phenethyl)urea is C9H12N2O.
What is the molecular weight of alpha-(N-1-phenethyl)urea?
The molecular weight of alpha-(N-1-phenethyl)urea is 164.09 g/mol.
Where can I buy alpha-(N-1-phenethyl)urea?
You can request a quote for alpha-(N-1-phenethyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-(N-1-phenethyl)urea?
Yes, KEHONG BIO provides custom synthesis services for alpha-(N-1-phenethyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.