6,8-dibromo-2-methyl-3-(o-tolyl)quinazolin-4(3H)-one
TL;DR: 6,8-dibromo-2-methyl-3-(o-tolyl)quinazolin-4(3H)-one (CAS 4621-73-2) is a chemical compound with molecular formula C16H12Br2N2O and molecular weight 405.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,8-dibromo-2-methyl-3-(2-methylphenyl)quinazolin-4-one
Also Known As: 6,8-dibromo-2-methyl-3-(o-tolyl)quinazolin-4(3H)-one, 6,8-dibromo-2-methyl-3-(2-methylphenyl)quinazolin-4-one, 6,8-dibromo-2-methyl-3-(2-methylphenyl)quinazolin-4(3H)-one
| Molecular Formula | C16H12Br2N2O |
|---|---|
| Molecular Weight | 405.93 g/mol |
| LogP | 4.52754 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 405.93164 |
| Heavy Atoms | 21 |
| Complexity | 916.0294 |
Chemical Identifiers
| CAS Number | 4621-73-2 |
|---|---|
| SMILES | CC1=CC=CC=C1N2C(=NC3=C(C2=O)C=C(C=C3Br)Br)C |
Product Overview
6,8-dibromo-2-methyl-3-(o-tolyl)quinazolin-4(3H)-one (CAS 4621-73-2), with molecular formula C16H12Br2N2O and molecular weight 405.93 g/mol. IUPAC: 6,8-dibromo-2-methyl-3-(2-methylphenyl)quinazolin-4-one.
Chemical Property Profile of 6,8-dibromo-2-methyl-3-(o-tolyl)quinazolin-4(3H)-one
Property Insights of 6,8-dibromo-2-methyl-3-(o-tolyl)quinazolin-4(3H)-one
The XLogP value of 4.52754 indicates that 6,8-dibromo-2-methyl-3-(o-tolyl)quinazolin-4(3H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, 6,8-dibromo-2-methyl-3-(o-tolyl)quinazolin-4(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,8-dibromo-2-methyl-3-(o-tolyl)quinazolin-4(3H)-one 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 6,8-dibromo-2-methyl-3-(o-tolyl)quinazolin-4(3H)-one?
The CAS number of 6,8-dibromo-2-methyl-3-(o-tolyl)quinazolin-4(3H)-one is 4621-73-2.
What is the molecular formula of 6,8-dibromo-2-methyl-3-(o-tolyl)quinazolin-4(3H)-one?
The molecular formula of 6,8-dibromo-2-methyl-3-(o-tolyl)quinazolin-4(3H)-one is C16H12Br2N2O.
What is the molecular weight of 6,8-dibromo-2-methyl-3-(o-tolyl)quinazolin-4(3H)-one?
The molecular weight of 6,8-dibromo-2-methyl-3-(o-tolyl)quinazolin-4(3H)-one is 405.93 g/mol.
Where can I buy 6,8-dibromo-2-methyl-3-(o-tolyl)quinazolin-4(3H)-one?
You can request a quote for 6,8-dibromo-2-methyl-3-(o-tolyl)quinazolin-4(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,8-dibromo-2-methyl-3-(o-tolyl)quinazolin-4(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 6,8-dibromo-2-methyl-3-(o-tolyl)quinazolin-4(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.