1-Butyl-3-(1-naphthyl)urea
TL;DR: 1-Butyl-3-(1-naphthyl)urea (CAS 108619-31-4) is a chemical compound with molecular formula C15H18N2O and molecular weight 242.1419 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-butyl-3-naphthalen-1-ylurea
Also Known As: 1-Butyl-3-(1-naphthyl)urea, 3-butyl-1-(naphthalen-1-yl)urea, 1-Butyl-3-(naphthalen-1-yl)urea, N-butyl-N'-(1-naphthyl)urea, 1-butyl-3-naphthalen-1-ylurea
Technical Specifications
| Molecular Formula | C15H18N2O |
| Molecular Weight | 242.1419 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 41.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 242.1419 Da |
| Heavy Atoms | 18 |
| Complexity | 267.0 |
| SMILES | CCCCNC(=O)NC1=CC=CC2=CC=CC=C21 |
| InChIKey | KGTCAUPNMGXMDM-UHFFFAOYSA-N |
Chemical Property Profile of 1-Butyl-3-(1-naphthyl)urea
Property Insights of 1-Butyl-3-(1-naphthyl)urea
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Butyl-3-(1-naphthyl)urea. With a topological polar surface area (TPSA) of 41.1 Ų, 1-Butyl-3-(1-naphthyl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Butyl-3-(1-naphthyl)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
What is the CAS number of 1-Butyl-3-(1-naphthyl)urea?
The CAS number of 1-Butyl-3-(1-naphthyl)urea is 108619-31-4.
What is the molecular formula of 1-Butyl-3-(1-naphthyl)urea?
The molecular formula of 1-Butyl-3-(1-naphthyl)urea is C15H18N2O.
What is the molecular weight of 1-Butyl-3-(1-naphthyl)urea?
The molecular weight of 1-Butyl-3-(1-naphthyl)urea is 242.1419 g/mol.
Where can I buy 1-Butyl-3-(1-naphthyl)urea?
You can request a quote for 1-Butyl-3-(1-naphthyl)urea directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Butyl-3-(1-naphthyl)urea?
Yes, CoreyChem provides custom synthesis services for 1-Butyl-3-(1-naphthyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.