N-acetyl-N-butyl-N'-(4-chlorophenyl)urea
TL;DR: N-acetyl-N-butyl-N'-(4-chlorophenyl)urea (CAS 115956-79-1) is a chemical compound with molecular formula C13H17ClN2O2 and molecular weight 268.09787 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-butyl-N-[(4-chlorophenyl)carbamoyl]acetamide
Also Known As: 1-acetyl-1-butyl-3-(4-chlorophenyl)urea, 3-acetyl-3-butyl-1-(4-chlorophenyl)urea, N-acetyl-N-butyl-N'-(4-chlorophenyl)urea, N-butyl-N-[(4-chlorophenyl)carbamoyl]acetamide
Technical Specifications
| Molecular Formula | C13H17ClN2O2 |
| Molecular Weight | 268.09787 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 268.09787 Da |
| Heavy Atoms | 18 |
| Complexity | 289.0 |
| SMILES | CCCCN(C(=O)C)C(=O)NC1=CC=C(C=C1)Cl |
| InChIKey | RCXNAPHHHNRIGE-UHFFFAOYSA-N |
Chemical Property Profile of N-acetyl-N-butyl-N'-(4-chlorophenyl)urea
Property Insights of N-acetyl-N-butyl-N'-(4-chlorophenyl)urea
The XLogP value of 3.2 indicates that N-acetyl-N-butyl-N'-(4-chlorophenyl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.4 Ų, N-acetyl-N-butyl-N'-(4-chlorophenyl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-acetyl-N-butyl-N'-(4-chlorophenyl)urea has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-acetyl-N-butyl-N'-(4-chlorophenyl)urea?
The CAS number of N-acetyl-N-butyl-N'-(4-chlorophenyl)urea is 115956-79-1.
What is the molecular formula of N-acetyl-N-butyl-N'-(4-chlorophenyl)urea?
The molecular formula of N-acetyl-N-butyl-N'-(4-chlorophenyl)urea is C13H17ClN2O2.
What is the molecular weight of N-acetyl-N-butyl-N'-(4-chlorophenyl)urea?
The molecular weight of N-acetyl-N-butyl-N'-(4-chlorophenyl)urea is 268.09787 g/mol.
Where can I buy N-acetyl-N-butyl-N'-(4-chlorophenyl)urea?
You can request a quote for N-acetyl-N-butyl-N'-(4-chlorophenyl)urea directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-acetyl-N-butyl-N'-(4-chlorophenyl)urea?
Yes, CoreyChem provides custom synthesis services for N-acetyl-N-butyl-N'-(4-chlorophenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.