2-Methyl-3-(2-nitrophenyl)quinazoline-4(3H)-one
TL;DR: 2-Methyl-3-(2-nitrophenyl)quinazoline-4(3H)-one (CAS 1788-94-9) is a chemical compound with molecular formula C15H11N3O3 and molecular weight 281.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-3-(2-nitrophenyl)quinazolin-4-one
Also Known As: 2-methyl-3-(2-nitrophenyl)quinazolin-4(3H)-one, 2-Methyl-3-(2-nitrophenyl)-4(3H)-quinazolinone, BAS 00012308, 2-methyl-3-(2-nitrophenyl)quinazolin-4-one, 2-Methyl-3-(2-nitro-phenyl)-3H-quinazolin-4-one
| Molecular Formula | C15H11N3O3 |
|---|---|
| Molecular Weight | 281.08 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 78.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 281.08005 |
| Heavy Atoms | 21 |
| Complexity | 471.0 |
Chemical Identifiers
| CAS Number | 1788-94-9 |
|---|---|
| SMILES | CC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3[N+](=O)[O-] |
| InChIKey | HJMTVXOVYRQCTR-UHFFFAOYSA-N |
Product Overview
2-Methyl-3-(2-nitrophenyl)quinazoline-4(3H)-one (CAS 1788-94-9), with molecular formula C15H11N3O3 and molecular weight 281.08 g/mol. IUPAC: 2-methyl-3-(2-nitrophenyl)quinazolin-4-one.
Chemical Property Profile of 2-Methyl-3-(2-nitrophenyl)quinazoline-4(3H)-one
Property Insights of 2-Methyl-3-(2-nitrophenyl)quinazoline-4(3H)-one
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-3-(2-nitrophenyl)quinazoline-4(3H)-one. The TPSA of 78.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methyl-3-(2-nitrophenyl)quinazoline-4(3H)-one. Following Lipinski's Rule of Five, 2-Methyl-3-(2-nitrophenyl)quinazoline-4(3H)-one has 0 hydrogen bond donor(s) and 4 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 2-Methyl-3-(2-nitrophenyl)quinazoline-4(3H)-one?
The CAS number of 2-Methyl-3-(2-nitrophenyl)quinazoline-4(3H)-one is 1788-94-9.
What is the molecular formula of 2-Methyl-3-(2-nitrophenyl)quinazoline-4(3H)-one?
The molecular formula of 2-Methyl-3-(2-nitrophenyl)quinazoline-4(3H)-one is C15H11N3O3.
What is the molecular weight of 2-Methyl-3-(2-nitrophenyl)quinazoline-4(3H)-one?
The molecular weight of 2-Methyl-3-(2-nitrophenyl)quinazoline-4(3H)-one is 281.08 g/mol.
Where can I buy 2-Methyl-3-(2-nitrophenyl)quinazoline-4(3H)-one?
You can request a quote for 2-Methyl-3-(2-nitrophenyl)quinazoline-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 2-Methyl-3-(2-nitrophenyl)quinazoline-4(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-3-(2-nitrophenyl)quinazoline-4(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.