![N-Benzyl-N-{1-[3-(3-chloro-4-fluorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]propyl}-N'-(3-methylphenyl)urea structure](/static/products/5876/5876-64-2.webp)
N-Benzyl-N-{1-[3-(3-chloro-4-fluorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]propyl}-N'-(3-methylphenyl)urea
TL;DR: N-Benzyl-N-{1-[3-(3-chloro-4-fluorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]propyl}-N'-(3-methylphenyl)urea (CAS 5876-64-2) is a chemical compound with molecular formula C32H28ClFN4O2 and molecular weight 554.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-1-[1-[3-(3-chloro-4-fluorophenyl)-4-oxoquinazolin-2-yl]propyl]-3-(3-methylphenyl)urea
Also Known As: N-Benzyl-N-{1-[3-(3-chloro-4-fluorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]propyl}-N'-(3-methylphenyl)urea, 1-benzyl-1-[1-[3-(3-chloro-4-fluoro-phenyl)-4-oxo-quinazolin-2-yl]propyl]-3-(3-methylphenyl)urea, 1-benzyl-1-[1-[3-(3-chloro-4-fluorophenyl)-4-oxoquinazolin-2-yl]propyl]-3-(3-methylphenyl)urea
| Molecular Formula | C32H28ClFN4O2 |
|---|---|
| Molecular Weight | 554.19 g/mol |
| LogP | 7.67202 |
| Topological Polar Surface Area | 67.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 554.1885 |
| Heavy Atoms | 40 |
| Complexity | 1739.0155 |
Chemical Identifiers
| CAS Number | 5876-64-2 |
|---|---|
| SMILES | CCC(C1=NC2=CC=CC=C2C(=O)N1C3=CC(=C(C=C3)F)Cl)N(CC4=CC=CC=C4)C(=O)NC5=CC=CC(=C5)C |
Product Overview
N-Benzyl-N-{1-[3-(3-chloro-4-fluorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]propyl}-N'-(3-methylphenyl)urea (CAS 5876-64-2), with molecular formula C32H28ClFN4O2 and molecular weight 554.19 g/mol. IUPAC: 1-benzyl-1-[1-[3-(3-chloro-4-fluorophenyl)-4-oxoquinazolin-2-yl]propyl]-3-(3-methylphenyl)urea.
Chemical Property Profile of N-Benzyl-N-{1-[3-(3-chloro-4-fluorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]propyl}-N'-(3-methylphenyl)urea
Property Insights of N-Benzyl-N-{1-[3-(3-chloro-4-fluorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]propyl}-N'-(3-methylphenyl)urea
The XLogP value of 7.67202 indicates that N-Benzyl-N-{1-[3-(3-chloro-4-fluorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]propyl}-N'-(3-methylphenyl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.23 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Benzyl-N-{1-[3-(3-chloro-4-fluorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]propyl}-N'-(3-methylphenyl)urea. Following Lipinski's Rule of Five, N-Benzyl-N-{1-[3-(3-chloro-4-fluorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]propyl}-N'-(3-methylphenyl)urea has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-Benzyl-N-{1-[3-(3-chloro-4-fluorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]propyl}-N'-(3-methylphenyl)urea?
The CAS number of N-Benzyl-N-{1-[3-(3-chloro-4-fluorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]propyl}-N'-(3-methylphenyl)urea is 5876-64-2.
What is the molecular formula of N-Benzyl-N-{1-[3-(3-chloro-4-fluorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]propyl}-N'-(3-methylphenyl)urea?
The molecular formula of N-Benzyl-N-{1-[3-(3-chloro-4-fluorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]propyl}-N'-(3-methylphenyl)urea is C32H28ClFN4O2.
What is the molecular weight of N-Benzyl-N-{1-[3-(3-chloro-4-fluorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]propyl}-N'-(3-methylphenyl)urea?
The molecular weight of N-Benzyl-N-{1-[3-(3-chloro-4-fluorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]propyl}-N'-(3-methylphenyl)urea is 554.19 g/mol.
Where can I buy N-Benzyl-N-{1-[3-(3-chloro-4-fluorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]propyl}-N'-(3-methylphenyl)urea?
You can request a quote for N-Benzyl-N-{1-[3-(3-chloro-4-fluorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]propyl}-N'-(3-methylphenyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Benzyl-N-{1-[3-(3-chloro-4-fluorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]propyl}-N'-(3-methylphenyl)urea?
Yes, KEHONG BIO provides custom synthesis services for N-Benzyl-N-{1-[3-(3-chloro-4-fluorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]propyl}-N'-(3-methylphenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.