7-chloro-3-(4-nitrobenzyl)-4(3H)-quinazolinone
TL;DR: 7-chloro-3-(4-nitrobenzyl)-4(3H)-quinazolinone (CAS 201299-00-5) is a chemical compound with molecular formula C15H10ClN3O3 and molecular weight 315.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-chloro-3-[(4-nitrophenyl)methyl]quinazolin-4-one
Also Known As: 7-chloro-3-[(4-nitrophenyl)methyl]quinazolin-4-one, 7-chloro-3-(4-nitrobenzyl)-4(3H)-quinazolinone, 4(3H)-Quinazolinone, 7-chloro-3-[(4-nitrophenyl)methyl]-, 7-chloro-3-[(4-nitrophenyl)methyl]-3,4-dihydroquinazolin-4-one
| Molecular Formula | C15H10ClN3O3 |
|---|---|
| Molecular Weight | 315.04 g/mol |
| LogP | 3.0064 |
| Topological Polar Surface Area | 78.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 315.04108 |
| Heavy Atoms | 22 |
| Complexity | 919.45917 |
Chemical Identifiers
| CAS Number | 201299-00-5 |
|---|---|
| SMILES | C1=CC(=CC=C1CN2C=NC3=C(C2=O)C=CC(=C3)Cl)[N+](=O)[O-] |
Product Overview
7-chloro-3-(4-nitrobenzyl)-4(3H)-quinazolinone (CAS 201299-00-5), with molecular formula C15H10ClN3O3 and molecular weight 315.04 g/mol. IUPAC: 7-chloro-3-[(4-nitrophenyl)methyl]quinazolin-4-one.
Chemical Property Profile of 7-chloro-3-(4-nitrobenzyl)-4(3H)-quinazolinone
Property Insights of 7-chloro-3-(4-nitrobenzyl)-4(3H)-quinazolinone
The XLogP value of 3.0064 indicates that 7-chloro-3-(4-nitrobenzyl)-4(3H)-quinazolinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.03 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-chloro-3-(4-nitrobenzyl)-4(3H)-quinazolinone. Following Lipinski's Rule of Five, 7-chloro-3-(4-nitrobenzyl)-4(3H)-quinazolinone has 0 hydrogen bond donor(s) and 4 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 7-chloro-3-(4-nitrobenzyl)-4(3H)-quinazolinone?
The CAS number of 7-chloro-3-(4-nitrobenzyl)-4(3H)-quinazolinone is 201299-00-5.
What is the molecular formula of 7-chloro-3-(4-nitrobenzyl)-4(3H)-quinazolinone?
The molecular formula of 7-chloro-3-(4-nitrobenzyl)-4(3H)-quinazolinone is C15H10ClN3O3.
What is the molecular weight of 7-chloro-3-(4-nitrobenzyl)-4(3H)-quinazolinone?
The molecular weight of 7-chloro-3-(4-nitrobenzyl)-4(3H)-quinazolinone is 315.04 g/mol.
Where can I buy 7-chloro-3-(4-nitrobenzyl)-4(3H)-quinazolinone?
You can request a quote for 7-chloro-3-(4-nitrobenzyl)-4(3H)-quinazolinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-chloro-3-(4-nitrobenzyl)-4(3H)-quinazolinone?
Yes, KEHONG BIO provides custom synthesis services for 7-chloro-3-(4-nitrobenzyl)-4(3H)-quinazolinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.