![(3Z)-2-Acetyl-3-[(3-methoxyphenyl)imino]-6-nitro-2,3-dihydro-1H-inden-1-one structure](/static/products/5474/5474-53-3.webp)
(3Z)-2-Acetyl-3-[(3-methoxyphenyl)imino]-6-nitro-2,3-dihydro-1H-inden-1-one
TL;DR: (3Z)-2-Acetyl-3-[(3-methoxyphenyl)imino]-6-nitro-2,3-dihydro-1H-inden-1-one (CAS 5474-53-3) is a chemical compound with molecular formula C18H14N2O5 and molecular weight 338.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-acetyl-3-(3-methoxyphenyl)imino-6-nitroinden-1-one
Also Known As: BIM-0020956.P001, 2-acetyl-3-(3-methoxyphenyl)imino-6-nitroinden-1-one, (3Z)-2-Acetyl-3-[(3-methoxyphenyl)imino]-6-nitro-2,3-dihydro-1H-inden-1-one
| Molecular Formula | C18H14N2O5 |
|---|---|
| Molecular Weight | 338.09 g/mol |
| LogP | 3.1257 |
| Topological Polar Surface Area | 98.87 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 338.09027 |
| Heavy Atoms | 25 |
| Complexity | 932.8137 |
Chemical Identifiers
| CAS Number | 5474-53-3 |
|---|---|
| SMILES | CC(=O)C1C(=NC2=CC(=CC=C2)OC)C3=C(C1=O)C=C(C=C3)[N+](=O)[O-] |
Product Overview
(3Z)-2-Acetyl-3-[(3-methoxyphenyl)imino]-6-nitro-2,3-dihydro-1H-inden-1-one (CAS 5474-53-3), with molecular formula C18H14N2O5 and molecular weight 338.09 g/mol. IUPAC: 2-acetyl-3-(3-methoxyphenyl)imino-6-nitroinden-1-one.
Chemical Property Profile of (3Z)-2-Acetyl-3-[(3-methoxyphenyl)imino]-6-nitro-2,3-dihydro-1H-inden-1-one
Property Insights of (3Z)-2-Acetyl-3-[(3-methoxyphenyl)imino]-6-nitro-2,3-dihydro-1H-inden-1-one
The XLogP value of 3.1257 indicates that (3Z)-2-Acetyl-3-[(3-methoxyphenyl)imino]-6-nitro-2,3-dihydro-1H-inden-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.87 Ų falls within the moderate polarity range, balancing permeability and solubility for (3Z)-2-Acetyl-3-[(3-methoxyphenyl)imino]-6-nitro-2,3-dihydro-1H-inden-1-one. Following Lipinski's Rule of Five, (3Z)-2-Acetyl-3-[(3-methoxyphenyl)imino]-6-nitro-2,3-dihydro-1H-inden-1-one 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 (3Z)-2-Acetyl-3-[(3-methoxyphenyl)imino]-6-nitro-2,3-dihydro-1H-inden-1-one?
The CAS number of (3Z)-2-Acetyl-3-[(3-methoxyphenyl)imino]-6-nitro-2,3-dihydro-1H-inden-1-one is 5474-53-3.
What is the molecular formula of (3Z)-2-Acetyl-3-[(3-methoxyphenyl)imino]-6-nitro-2,3-dihydro-1H-inden-1-one?
The molecular formula of (3Z)-2-Acetyl-3-[(3-methoxyphenyl)imino]-6-nitro-2,3-dihydro-1H-inden-1-one is C18H14N2O5.
What is the molecular weight of (3Z)-2-Acetyl-3-[(3-methoxyphenyl)imino]-6-nitro-2,3-dihydro-1H-inden-1-one?
The molecular weight of (3Z)-2-Acetyl-3-[(3-methoxyphenyl)imino]-6-nitro-2,3-dihydro-1H-inden-1-one is 338.09 g/mol.
Where can I buy (3Z)-2-Acetyl-3-[(3-methoxyphenyl)imino]-6-nitro-2,3-dihydro-1H-inden-1-one?
You can request a quote for (3Z)-2-Acetyl-3-[(3-methoxyphenyl)imino]-6-nitro-2,3-dihydro-1H-inden-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3Z)-2-Acetyl-3-[(3-methoxyphenyl)imino]-6-nitro-2,3-dihydro-1H-inden-1-one?
Yes, KEHONG BIO provides custom synthesis services for (3Z)-2-Acetyl-3-[(3-methoxyphenyl)imino]-6-nitro-2,3-dihydro-1H-inden-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.