2-acetyl-3-(2-hydroxy-4-nitrophenyl)imino-7-nitroinden-1-one
TL;DR: 2-acetyl-3-(2-hydroxy-4-nitrophenyl)imino-7-nitroinden-1-one (CAS 202328-76-5) is a chemical compound with molecular formula C17H11N3O7 and molecular weight 369.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-acetyl-3-(2-hydroxy-4-nitrophenyl)imino-7-nitroinden-1-one
Also Known As: 2-acetyl-3-(2-hydroxy-4-nitrophenyl)imino-7-nitroinden-1-one, 2-acetyl-3-(2-hydroxy-4-nitro-phenyl)imino-7-nitro-inden-1-one, (E)-2-acetyl-3-((2-hydroxy-4-nitrophenyl)imino)-7-nitro-2,3-dihydro-1H-inden-1-one
| Molecular Formula | C17H11N3O7 |
|---|---|
| Molecular Weight | 369.06 g/mol |
| LogP | 2.7309 |
| Topological Polar Surface Area | 153.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 369.0597 |
| Heavy Atoms | 27 |
| Complexity | 1058.4877 |
Chemical Identifiers
| CAS Number | 202328-76-5 |
|---|---|
| SMILES | CC(=O)C1C(=NC2=C(C=C(C=C2)[N+](=O)[O-])O)C3=C(C1=O)C(=CC=C3)[N+](=O)[O-] |
Product Overview
2-acetyl-3-(2-hydroxy-4-nitrophenyl)imino-7-nitroinden-1-one (CAS 202328-76-5), with molecular formula C17H11N3O7 and molecular weight 369.06 g/mol. IUPAC: 2-acetyl-3-(2-hydroxy-4-nitrophenyl)imino-7-nitroinden-1-one.
Chemical Property Profile of 2-acetyl-3-(2-hydroxy-4-nitrophenyl)imino-7-nitroinden-1-one
Property Insights of 2-acetyl-3-(2-hydroxy-4-nitrophenyl)imino-7-nitroinden-1-one
The XLogP value of 2.7309 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-acetyl-3-(2-hydroxy-4-nitrophenyl)imino-7-nitroinden-1-one. The TPSA of 153.01 Ų indicates high polarity, suggesting 2-acetyl-3-(2-hydroxy-4-nitrophenyl)imino-7-nitroinden-1-one may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-acetyl-3-(2-hydroxy-4-nitrophenyl)imino-7-nitroinden-1-one has 1 hydrogen bond donor(s) and 8 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-acetyl-3-(2-hydroxy-4-nitrophenyl)imino-7-nitroinden-1-one?
The CAS number of 2-acetyl-3-(2-hydroxy-4-nitrophenyl)imino-7-nitroinden-1-one is 202328-76-5.
What is the molecular formula of 2-acetyl-3-(2-hydroxy-4-nitrophenyl)imino-7-nitroinden-1-one?
The molecular formula of 2-acetyl-3-(2-hydroxy-4-nitrophenyl)imino-7-nitroinden-1-one is C17H11N3O7.
What is the molecular weight of 2-acetyl-3-(2-hydroxy-4-nitrophenyl)imino-7-nitroinden-1-one?
The molecular weight of 2-acetyl-3-(2-hydroxy-4-nitrophenyl)imino-7-nitroinden-1-one is 369.06 g/mol.
Where can I buy 2-acetyl-3-(2-hydroxy-4-nitrophenyl)imino-7-nitroinden-1-one?
You can request a quote for 2-acetyl-3-(2-hydroxy-4-nitrophenyl)imino-7-nitroinden-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-acetyl-3-(2-hydroxy-4-nitrophenyl)imino-7-nitroinden-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2-acetyl-3-(2-hydroxy-4-nitrophenyl)imino-7-nitroinden-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.