4(3H)-Quinazolinone, 3-(4-bromo-o-tolyl)-2-methyl-, monohydrochloride
TL;DR: 4(3H)-Quinazolinone, 3-(4-bromo-o-tolyl)-2-methyl-, monohydrochloride (CAS 40712-66-1) is a chemical compound with molecular formula C16H14BrClN2O and molecular weight 364.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-bromo-2-methylphenyl)-2-methylquinazolin-4-one;hydrochloride
Also Known As: 4(3H)-Quinazolinone, 3-(4-bromo-o-tolyl)-2-methyl-, monohydrochloride, 2-Metil-3-(o-tolil-p-bromo)-4-chinazolone cloridrato, 2-Metil-3-(o-tolil-p-bromo)-4-chinazolone cloridrato [Italian], 3-(4-Bromo-o-tolyl)-2-methyl-4(3H)-quinazolinone hydrochloride, 3-(4-Bromo-2-methylphenyl)-2-methyl-4(3H)-quinazolinone hydrochloride
| Molecular Formula | C16H14BrClN2O |
|---|---|
| Molecular Weight | 364.00 g/mol |
| LogP | 4.19 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 363.9978 |
| Heavy Atoms | 21 |
| Complexity | 423.0 |
Chemical Identifiers
| CAS Number | 40712-66-1 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)Br)N2C(=NC3=CC=CC=C3C2=O)C.Cl |
| InChIKey | KNVLXYGGPVIBEH-UHFFFAOYSA-N |
Product Overview
4(3H)-Quinazolinone, 3-(4-bromo-o-tolyl)-2-methyl-, monohydrochloride (CAS 40712-66-1), with molecular formula C16H14BrClN2O and molecular weight 364.00 g/mol. IUPAC: 3-(4-bromo-2-methylphenyl)-2-methylquinazolin-4-one;hydrochloride.
Chemical Property Profile of 4(3H)-Quinazolinone, 3-(4-bromo-o-tolyl)-2-methyl-, monohydrochloride
Property Insights of 4(3H)-Quinazolinone, 3-(4-bromo-o-tolyl)-2-methyl-, monohydrochloride
The XLogP value of 4.19 indicates that 4(3H)-Quinazolinone, 3-(4-bromo-o-tolyl)-2-methyl-, monohydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.7 Ų, 4(3H)-Quinazolinone, 3-(4-bromo-o-tolyl)-2-methyl-, monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4(3H)-Quinazolinone, 3-(4-bromo-o-tolyl)-2-methyl-, monohydrochloride 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
Frequently Asked Questions
What is the CAS number of 4(3H)-Quinazolinone, 3-(4-bromo-o-tolyl)-2-methyl-, monohydrochloride?
The CAS number of 4(3H)-Quinazolinone, 3-(4-bromo-o-tolyl)-2-methyl-, monohydrochloride is 40712-66-1.
What is the molecular formula of 4(3H)-Quinazolinone, 3-(4-bromo-o-tolyl)-2-methyl-, monohydrochloride?
The molecular formula of 4(3H)-Quinazolinone, 3-(4-bromo-o-tolyl)-2-methyl-, monohydrochloride is C16H14BrClN2O.
What is the molecular weight of 4(3H)-Quinazolinone, 3-(4-bromo-o-tolyl)-2-methyl-, monohydrochloride?
The molecular weight of 4(3H)-Quinazolinone, 3-(4-bromo-o-tolyl)-2-methyl-, monohydrochloride is 364.00 g/mol.
Where can I buy 4(3H)-Quinazolinone, 3-(4-bromo-o-tolyl)-2-methyl-, monohydrochloride?
You can request a quote for 4(3H)-Quinazolinone, 3-(4-bromo-o-tolyl)-2-methyl-, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4(3H)-Quinazolinone, 3-(4-bromo-o-tolyl)-2-methyl-, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 4(3H)-Quinazolinone, 3-(4-bromo-o-tolyl)-2-methyl-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.