2-(chloromethyl)-3-(4-chloro-2-methylphenyl)-4(3H)-quinazolinone
TL;DR: 2-(chloromethyl)-3-(4-chloro-2-methylphenyl)-4(3H)-quinazolinone (CAS 69123-64-4) is a chemical compound with molecular formula C16H12Cl2N2O and molecular weight 318.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(chloromethyl)-3-(4-chloro-2-methylphenyl)quinazolin-4-one
Also Known As: 2-(chloromethyl)-3-(4-chloro-2-methylphenyl)-4(3H)-quinazolinone, 5K-636S, 3-(4-chloro-2-methylphenyl)-2-(chloromethyl)-3,4-dihydroquinazolin-4-one, 2-(chloromethyl)-3-(4-chloro-2-methylphenyl)quinazolin-4-one, 2-(chloromethyl)-3-(4-chloro-2-methyl-phenyl)quinazolin-4-one
| Molecular Formula | C16H12Cl2N2O |
|---|---|
| Molecular Weight | 318.03 g/mol |
| LogP | 4.08632 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 318.03265 |
| Heavy Atoms | 21 |
| Complexity | 887.06964 |
Chemical Identifiers
| CAS Number | 69123-64-4 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)Cl)N2C(=NC3=CC=CC=C3C2=O)CCl |
Product Overview
2-(chloromethyl)-3-(4-chloro-2-methylphenyl)-4(3H)-quinazolinone (CAS 69123-64-4), with molecular formula C16H12Cl2N2O and molecular weight 318.03 g/mol. IUPAC: 2-(chloromethyl)-3-(4-chloro-2-methylphenyl)quinazolin-4-one.
Chemical Property Profile of 2-(chloromethyl)-3-(4-chloro-2-methylphenyl)-4(3H)-quinazolinone
Property Insights of 2-(chloromethyl)-3-(4-chloro-2-methylphenyl)-4(3H)-quinazolinone
The XLogP value of 4.08632 indicates that 2-(chloromethyl)-3-(4-chloro-2-methylphenyl)-4(3H)-quinazolinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, 2-(chloromethyl)-3-(4-chloro-2-methylphenyl)-4(3H)-quinazolinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(chloromethyl)-3-(4-chloro-2-methylphenyl)-4(3H)-quinazolinone has 0 hydrogen bond donor(s) and 2 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 2-(chloromethyl)-3-(4-chloro-2-methylphenyl)-4(3H)-quinazolinone?
The CAS number of 2-(chloromethyl)-3-(4-chloro-2-methylphenyl)-4(3H)-quinazolinone is 69123-64-4.
What is the molecular formula of 2-(chloromethyl)-3-(4-chloro-2-methylphenyl)-4(3H)-quinazolinone?
The molecular formula of 2-(chloromethyl)-3-(4-chloro-2-methylphenyl)-4(3H)-quinazolinone is C16H12Cl2N2O.
What is the molecular weight of 2-(chloromethyl)-3-(4-chloro-2-methylphenyl)-4(3H)-quinazolinone?
The molecular weight of 2-(chloromethyl)-3-(4-chloro-2-methylphenyl)-4(3H)-quinazolinone is 318.03 g/mol.
Where can I buy 2-(chloromethyl)-3-(4-chloro-2-methylphenyl)-4(3H)-quinazolinone?
You can request a quote for 2-(chloromethyl)-3-(4-chloro-2-methylphenyl)-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 2-(chloromethyl)-3-(4-chloro-2-methylphenyl)-4(3H)-quinazolinone?
Yes, KEHONG BIO provides custom synthesis services for 2-(chloromethyl)-3-(4-chloro-2-methylphenyl)-4(3H)-quinazolinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.