RefChem:284253
TL;DR: RefChem:284253 (CAS 40889-65-4) is a chemical compound with molecular formula C19H16BrN5O2 and molecular weight 425.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-bromo-2-methyl-3-[[5-(3-methylanilino)-1,3,4-oxadiazol-2-yl]methyl]quinazolin-4-one
Also Known As: 4(3H)-Quinazolinone, 6-bromo-2-methyl-3-((5-((3-methylphenyl)amino)-1,3,4-oxadiazol-2-yl)methyl)-, 6-bromo-2-methyl-3-[[5-(3-methylanilino)-1,3,4-oxadiazol-2-yl]methyl]quinazolin-4-one, 6-Bromo-2-methyl-3-{[5-(3-methylanilino)-1,3,4-oxadiazol-2-yl]methyl}quinazolin-4(3H)-one, BRN 1047175, RefChem:284253
| Molecular Formula | C19H16BrN5O2 |
|---|---|
| Molecular Weight | 425.05 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 83.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 425.04874 |
| Heavy Atoms | 27 |
| Complexity | 588.0 |
Chemical Identifiers
| CAS Number | 40889-65-4 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NC2=NN=C(O2)CN3C(=NC4=C(C3=O)C=C(C=C4)Br)C |
| InChIKey | TVQCZEQYODYEMN-UHFFFAOYSA-N |
Product Overview
RefChem:284253 (CAS 40889-65-4), with molecular formula C19H16BrN5O2 and molecular weight 425.05 g/mol. IUPAC: 6-bromo-2-methyl-3-[[5-(3-methylanilino)-1,3,4-oxadiazol-2-yl]methyl]quinazolin-4-one.
Chemical Property Profile of RefChem:284253
Property Insights of RefChem:284253
The XLogP value of 3.2 indicates that RefChem:284253 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.6 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:284253. Following Lipinski's Rule of Five, RefChem:284253 has 1 hydrogen bond donor(s) and 6 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 RefChem:284253?
The CAS number of RefChem:284253 is 40889-65-4.
What is the molecular formula of RefChem:284253?
The molecular formula of RefChem:284253 is C19H16BrN5O2.
What is the molecular weight of RefChem:284253?
The molecular weight of RefChem:284253 is 425.05 g/mol.
Where can I buy RefChem:284253?
You can request a quote for RefChem:284253 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:284253?
Yes, KEHONG BIO provides custom synthesis services for RefChem:284253 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.