RefChem:284261
TL;DR: RefChem:284261 (CAS 40889-66-5) is a chemical compound with molecular formula C19H16BrN5O3 and molecular weight 441.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-bromo-3-[[5-(4-methoxyanilino)-1,3,4-oxadiazol-2-yl]methyl]-2-methylquinazolin-4-one
Also Known As: 4(3H)-Quinazolinone, 6-bromo-3-((5-((4-methoxyphenyl)amino)-1,3,4-oxadiazol-2-yl)methyl)-2-methyl-, 6-bromo-3-[[5-(4-methoxyanilino)-1,3,4-oxadiazol-2-yl]methyl]-2-methylquinazolin-4-one, 6-Bromo-3-{[5-(4-methoxyanilino)-1,3,4-oxadiazol-2-yl]methyl}-2-methylquinazolin-4(3H)-one, BRN 1049922, RefChem:284261
| Molecular Formula | C19H16BrN5O3 |
|---|---|
| Molecular Weight | 441.04 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 92.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 441.04364 |
| Heavy Atoms | 28 |
| Complexity | 598.0 |
Chemical Identifiers
| CAS Number | 40889-66-5 |
|---|---|
| SMILES | CC1=NC2=C(C=C(C=C2)Br)C(=O)N1CC3=NN=C(O3)NC4=CC=C(C=C4)OC |
| InChIKey | ZTMWVEKMTWIHPX-UHFFFAOYSA-N |
Product Overview
RefChem:284261 (CAS 40889-66-5), with molecular formula C19H16BrN5O3 and molecular weight 441.04 g/mol. IUPAC: 6-bromo-3-[[5-(4-methoxyanilino)-1,3,4-oxadiazol-2-yl]methyl]-2-methylquinazolin-4-one.
Chemical Property Profile of RefChem:284261
Property Insights of RefChem:284261
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:284261. The TPSA of 92.9 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:284261. Following Lipinski's Rule of Five, RefChem:284261 has 1 hydrogen bond donor(s) and 7 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:284261?
The CAS number of RefChem:284261 is 40889-66-5.
What is the molecular formula of RefChem:284261?
The molecular formula of RefChem:284261 is C19H16BrN5O3.
What is the molecular weight of RefChem:284261?
The molecular weight of RefChem:284261 is 441.04 g/mol.
Where can I buy RefChem:284261?
You can request a quote for RefChem:284261 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:284261?
Yes, KEHONG BIO provides custom synthesis services for RefChem:284261 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.