1,1-Dibutyl-3-(O-tolyl)urea
TL;DR: 1,1-Dibutyl-3-(O-tolyl)urea (CAS 56124-72-2) is a chemical compound with molecular formula C16H26N2O and molecular weight 262.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1-dibutyl-3-(2-methylphenyl)urea
Also Known As: 4-nitroindan-1-ol, 1,1-Dibutyl-3-(o-tolyl)urea, 1,1-dibutyl-3-(2-methylphenyl)urea, 3,3-dibutyl-1-(2-methylphenyl)urea, N,N-Dibutyl-N'-(2-methylphenyl)urea
| Molecular Formula | C16H26N2O |
|---|---|
| Molecular Weight | 262.20 g/mol |
| LogP | 4.42912 |
| Topological Polar Surface Area | 32.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Exact Mass | 262.2045 |
| Heavy Atoms | 19 |
| Complexity | 382.09024 |
Chemical Identifiers
| CAS Number | 56124-72-2 |
|---|---|
| SMILES | CCCCN(CCCC)C(=O)NC1=CC=CC=C1C |
Product Overview
1,1-Dibutyl-3-(O-tolyl)urea (CAS 56124-72-2), with molecular formula C16H26N2O and molecular weight 262.20 g/mol. IUPAC: 1,1-dibutyl-3-(2-methylphenyl)urea.
Chemical Property Profile of 1,1-Dibutyl-3-(O-tolyl)urea
Property Insights of 1,1-Dibutyl-3-(O-tolyl)urea
The XLogP value of 4.42912 indicates that 1,1-Dibutyl-3-(O-tolyl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.34 Ų, 1,1-Dibutyl-3-(O-tolyl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1-Dibutyl-3-(O-tolyl)urea 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 1,1-Dibutyl-3-(O-tolyl)urea?
The CAS number of 1,1-Dibutyl-3-(O-tolyl)urea is 56124-72-2.
What is the molecular formula of 1,1-Dibutyl-3-(O-tolyl)urea?
The molecular formula of 1,1-Dibutyl-3-(O-tolyl)urea is C16H26N2O.
What is the molecular weight of 1,1-Dibutyl-3-(O-tolyl)urea?
The molecular weight of 1,1-Dibutyl-3-(O-tolyl)urea is 262.20 g/mol.
Where can I buy 1,1-Dibutyl-3-(O-tolyl)urea?
You can request a quote for 1,1-Dibutyl-3-(O-tolyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1-Dibutyl-3-(O-tolyl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1,1-Dibutyl-3-(O-tolyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.