![5-methyl-3-nitro-12H-quino[2,1-b]quinazolin-12-one structure](/static/products/442/442568-79-8.png)
5-methyl-3-nitro-12H-quino[2,1-b]quinazolin-12-one
TL;DR: 5-methyl-3-nitro-12H-quino[2,1-b]quinazolin-12-one (CAS 442568-79-8) is a chemical compound with molecular formula C17H11N3O3 and molecular weight 305.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-3-nitroquinolino[2,1-b]quinazolin-12-one
Also Known As: 5-methyl-3-nitroquinolino[2,1-b]quinazolin-12-one, 5-methyl-3-nitro-12H-quino[2,1-b]quinazolin-12-one, 13-METHYL-2-NITRO-6H-5A,11-DIAZATETRAPHEN-6-ONE, 5-methyl-3-nitro-12H-quinolino[2,1-b]quinazolin-12-one
| Molecular Formula | C17H11N3O3 |
|---|---|
| Molecular Weight | 305.08 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 78.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 305.08005 |
| Heavy Atoms | 23 |
| Complexity | 607.0 |
Chemical Identifiers
| CAS Number | 442568-79-8 |
|---|---|
| SMILES | CC1=CC2=NC3=CC=CC=C3C(=O)N2C4=C1C=C(C=C4)[N+](=O)[O-] |
| InChIKey | XIYPFXDCUOQKGK-UHFFFAOYSA-N |
Product Overview
5-methyl-3-nitro-12H-quino[2,1-b]quinazolin-12-one (CAS 442568-79-8), with molecular formula C17H11N3O3 and molecular weight 305.08 g/mol. IUPAC: 5-methyl-3-nitroquinolino[2,1-b]quinazolin-12-one.
Chemical Property Profile of 5-methyl-3-nitro-12H-quino[2,1-b]quinazolin-12-one
Property Insights of 5-methyl-3-nitro-12H-quino[2,1-b]quinazolin-12-one
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-methyl-3-nitro-12H-quino[2,1-b]quinazolin-12-one. The TPSA of 78.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-methyl-3-nitro-12H-quino[2,1-b]quinazolin-12-one. Following Lipinski's Rule of Five, 5-methyl-3-nitro-12H-quino[2,1-b]quinazolin-12-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 5-methyl-3-nitro-12H-quino[2,1-b]quinazolin-12-one?
The CAS number of 5-methyl-3-nitro-12H-quino[2,1-b]quinazolin-12-one is 442568-79-8.
What is the molecular formula of 5-methyl-3-nitro-12H-quino[2,1-b]quinazolin-12-one?
The molecular formula of 5-methyl-3-nitro-12H-quino[2,1-b]quinazolin-12-one is C17H11N3O3.
What is the molecular weight of 5-methyl-3-nitro-12H-quino[2,1-b]quinazolin-12-one?
The molecular weight of 5-methyl-3-nitro-12H-quino[2,1-b]quinazolin-12-one is 305.08 g/mol.
Where can I buy 5-methyl-3-nitro-12H-quino[2,1-b]quinazolin-12-one?
You can request a quote for 5-methyl-3-nitro-12H-quino[2,1-b]quinazolin-12-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-methyl-3-nitro-12H-quino[2,1-b]quinazolin-12-one?
Yes, KEHONG BIO provides custom synthesis services for 5-methyl-3-nitro-12H-quino[2,1-b]quinazolin-12-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.