1,1-dibutyl-3-(4-nitrophenyl)urea
TL;DR: 1,1-dibutyl-3-(4-nitrophenyl)urea (CAS 122020-32-0) is a chemical compound with molecular formula C15H23N3O3 and molecular weight 293.17395 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,1-dibutyl-3-(4-nitrophenyl)urea
Also Known As: 1,1-dibutyl-3-(4-nitrophenyl)urea
Technical Specifications
| Molecular Formula | C15H23N3O3 |
| Molecular Weight | 293.17395 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 78.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 293.17395 Da |
| Heavy Atoms | 21 |
| Complexity | 315.0 |
| SMILES | CCCCN(CCCC)C(=O)NC1=CC=C(C=C1)[N+](=O)[O-] |
| InChIKey | WLDZWQKGXSUVSE-UHFFFAOYSA-N |
Chemical Property Profile of 1,1-dibutyl-3-(4-nitrophenyl)urea
Property Insights of 1,1-dibutyl-3-(4-nitrophenyl)urea
The XLogP value of 3.4 indicates that 1,1-dibutyl-3-(4-nitrophenyl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,1-dibutyl-3-(4-nitrophenyl)urea. Following Lipinski's Rule of Five, 1,1-dibutyl-3-(4-nitrophenyl)urea has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1,1-dibutyl-3-(4-nitrophenyl)urea?
The CAS number of 1,1-dibutyl-3-(4-nitrophenyl)urea is 122020-32-0.
What is the molecular formula of 1,1-dibutyl-3-(4-nitrophenyl)urea?
The molecular formula of 1,1-dibutyl-3-(4-nitrophenyl)urea is C15H23N3O3.
What is the molecular weight of 1,1-dibutyl-3-(4-nitrophenyl)urea?
The molecular weight of 1,1-dibutyl-3-(4-nitrophenyl)urea is 293.17395 g/mol.
Where can I buy 1,1-dibutyl-3-(4-nitrophenyl)urea?
You can request a quote for 1,1-dibutyl-3-(4-nitrophenyl)urea directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,1-dibutyl-3-(4-nitrophenyl)urea?
Yes, CoreyChem provides custom synthesis services for 1,1-dibutyl-3-(4-nitrophenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.