Pyrazolo(3,4-d)(1,3)oxazin-4(1H)-one, 1-methyl-6-(2-nitrophenyl)-
TL;DR: Pyrazolo(3,4-d)(1,3)oxazin-4(1H)-one, 1-methyl-6-(2-nitrophenyl)- (CAS 138187-95-8) is a chemical compound with molecular formula C12H8N4O4 and molecular weight 272.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-6-(2-nitrophenyl)pyrazolo[5,4-d][1,3]oxazin-4-one
Also Known As: Pyrazolo(3,4-d)(1,3)oxazin-4(1H)-one, 1-methyl-6-(2-nitrophenyl)-, 1-Methyl-6-(2-nitrophenyl)pyrazolo(3,4-d)(1,3)oxazin-4(1H)-one, 1-methyl-6-(2-nitrophenyl)pyrazolo[3,4-d][1,3]oxazin-4-one, 1-Methyl-6-(2-nitrophenyl)pyrazolo[3,4-d][1,3]oxazin-4(1H)-one, 1-methyl-6-(2-nitrophenyl)-1H,4H-pyrazolo[3,4-d][1,3]oxazin-4-one
| Molecular Formula | C12H8N4O4 |
|---|---|
| Molecular Weight | 272.05 g/mol |
| LogP | 1.4967 |
| Topological Polar Surface Area | 104.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 272.05457 |
| Heavy Atoms | 20 |
| Complexity | 880.53986 |
Chemical Identifiers
| CAS Number | 138187-95-8 |
|---|---|
| SMILES | CN1C2=C(C=N1)C(=O)OC(=N2)C3=CC=CC=C3[N+](=O)[O-] |
Product Overview
Pyrazolo(3,4-d)(1,3)oxazin-4(1H)-one, 1-methyl-6-(2-nitrophenyl)- (CAS 138187-95-8), with molecular formula C12H8N4O4 and molecular weight 272.05 g/mol. IUPAC: 1-methyl-6-(2-nitrophenyl)pyrazolo[5,4-d][1,3]oxazin-4-one.
Chemical Property Profile of Pyrazolo(3,4-d)(1,3)oxazin-4(1H)-one, 1-methyl-6-(2-nitrophenyl)-
Property Insights of Pyrazolo(3,4-d)(1,3)oxazin-4(1H)-one, 1-methyl-6-(2-nitrophenyl)-
The XLogP value of 1.4967 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrazolo(3,4-d)(1,3)oxazin-4(1H)-one, 1-methyl-6-(2-nitrophenyl)-. The TPSA of 104.06 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyrazolo(3,4-d)(1,3)oxazin-4(1H)-one, 1-methyl-6-(2-nitrophenyl)-. Following Lipinski's Rule of Five, Pyrazolo(3,4-d)(1,3)oxazin-4(1H)-one, 1-methyl-6-(2-nitrophenyl)- has 0 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 Pyrazolo(3,4-d)(1,3)oxazin-4(1H)-one, 1-methyl-6-(2-nitrophenyl)-?
The CAS number of Pyrazolo(3,4-d)(1,3)oxazin-4(1H)-one, 1-methyl-6-(2-nitrophenyl)- is 138187-95-8.
What is the molecular formula of Pyrazolo(3,4-d)(1,3)oxazin-4(1H)-one, 1-methyl-6-(2-nitrophenyl)-?
The molecular formula of Pyrazolo(3,4-d)(1,3)oxazin-4(1H)-one, 1-methyl-6-(2-nitrophenyl)- is C12H8N4O4.
What is the molecular weight of Pyrazolo(3,4-d)(1,3)oxazin-4(1H)-one, 1-methyl-6-(2-nitrophenyl)-?
The molecular weight of Pyrazolo(3,4-d)(1,3)oxazin-4(1H)-one, 1-methyl-6-(2-nitrophenyl)- is 272.05 g/mol.
Where can I buy Pyrazolo(3,4-d)(1,3)oxazin-4(1H)-one, 1-methyl-6-(2-nitrophenyl)-?
You can request a quote for Pyrazolo(3,4-d)(1,3)oxazin-4(1H)-one, 1-methyl-6-(2-nitrophenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrazolo(3,4-d)(1,3)oxazin-4(1H)-one, 1-methyl-6-(2-nitrophenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Pyrazolo(3,4-d)(1,3)oxazin-4(1H)-one, 1-methyl-6-(2-nitrophenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.