3-(4-Tert-butylbenzyl)-6,8-dichloro-4(3H)-quinazolinone
TL;DR: 3-(4-Tert-butylbenzyl)-6,8-dichloro-4(3H)-quinazolinone (CAS 853318-65-7) is a chemical compound with molecular formula C19H18Cl2N2O and molecular weight 360.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-tert-butylphenyl)methyl]-6,8-dichloroquinazolin-4-one
Also Known As: 3-(4-TERT-BUTYLBENZYL)-6,8-DICHLORO-4(3H)-QUINAZOLINONE, 3-(4-(tert-Butyl)benzyl)-6,8-dichloroquinazolin-4(3H)-one, 3-[(4-tert-butylphenyl)methyl]-6,8-dichloro-3,4-dihydroquinazolin-4-one, 3-[(4-tert-butylphenyl)methyl]-6,8-dichloroquinazolin-4-one, 662-032-7
| Molecular Formula | C19H18Cl2N2O |
|---|---|
| Molecular Weight | 360.08 g/mol |
| LogP | 5.0491 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 360.07962 |
| Heavy Atoms | 24 |
| Complexity | 953.9932 |
Chemical Identifiers
| CAS Number | 853318-65-7 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)CN2C=NC3=C(C2=O)C=C(C=C3Cl)Cl |
Product Overview
3-(4-Tert-butylbenzyl)-6,8-dichloro-4(3H)-quinazolinone (CAS 853318-65-7), with molecular formula C19H18Cl2N2O and molecular weight 360.08 g/mol. IUPAC: 3-[(4-tert-butylphenyl)methyl]-6,8-dichloroquinazolin-4-one.
Chemical Property Profile of 3-(4-Tert-butylbenzyl)-6,8-dichloro-4(3H)-quinazolinone
Property Insights of 3-(4-Tert-butylbenzyl)-6,8-dichloro-4(3H)-quinazolinone
The XLogP value of 5.0491 indicates that 3-(4-Tert-butylbenzyl)-6,8-dichloro-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, 3-(4-Tert-butylbenzyl)-6,8-dichloro-4(3H)-quinazolinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Tert-butylbenzyl)-6,8-dichloro-4(3H)-quinazolinone has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(4-Tert-butylbenzyl)-6,8-dichloro-4(3H)-quinazolinone?
The CAS number of 3-(4-Tert-butylbenzyl)-6,8-dichloro-4(3H)-quinazolinone is 853318-65-7.
What is the molecular formula of 3-(4-Tert-butylbenzyl)-6,8-dichloro-4(3H)-quinazolinone?
The molecular formula of 3-(4-Tert-butylbenzyl)-6,8-dichloro-4(3H)-quinazolinone is C19H18Cl2N2O.
What is the molecular weight of 3-(4-Tert-butylbenzyl)-6,8-dichloro-4(3H)-quinazolinone?
The molecular weight of 3-(4-Tert-butylbenzyl)-6,8-dichloro-4(3H)-quinazolinone is 360.08 g/mol.
Where can I buy 3-(4-Tert-butylbenzyl)-6,8-dichloro-4(3H)-quinazolinone?
You can request a quote for 3-(4-Tert-butylbenzyl)-6,8-dichloro-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 3-(4-Tert-butylbenzyl)-6,8-dichloro-4(3H)-quinazolinone?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Tert-butylbenzyl)-6,8-dichloro-4(3H)-quinazolinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.