2-(3,4-Dimethoxyphenyl)-3-(3-nitroanilino)inden-1-one
TL;DR: 2-(3,4-Dimethoxyphenyl)-3-(3-nitroanilino)inden-1-one (CAS 1024119-76-3) is a chemical compound with molecular formula C23H18N2O5 and molecular weight 402.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dimethoxyphenyl)-3-(3-nitroanilino)inden-1-one
Also Known As: 2-(3,4-dimethoxyphenyl)-3-(3-nitroanilino)inden-1-one, 2-(3,4-DIMETHOXYPHENYL)-3-((3-NITROPHENYL)AMINO)INDEN-1-ONE, 2-(3,4-dimethoxyphenyl)-3-[(3-nitrophenyl)amino]inden-1-one, 2-(3,4-dimethoxyphenyl)-3-[(3-nitrophenyl)amino]-1H-inden-1-one
| Molecular Formula | C23H18N2O5 |
|---|---|
| Molecular Weight | 402.12 g/mol |
| LogP | 4.7887 |
| Topological Polar Surface Area | 90.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 402.12158 |
| Heavy Atoms | 30 |
| Complexity | 1199.7028 |
Chemical Identifiers
| CAS Number | 1024119-76-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=C(C3=CC=CC=C3C2=O)NC4=CC(=CC=C4)[N+](=O)[O-])OC |
Product Overview
2-(3,4-Dimethoxyphenyl)-3-(3-nitroanilino)inden-1-one (CAS 1024119-76-3), with molecular formula C23H18N2O5 and molecular weight 402.12 g/mol. IUPAC: 2-(3,4-dimethoxyphenyl)-3-(3-nitroanilino)inden-1-one.
Chemical Property Profile of 2-(3,4-Dimethoxyphenyl)-3-(3-nitroanilino)inden-1-one
Property Insights of 2-(3,4-Dimethoxyphenyl)-3-(3-nitroanilino)inden-1-one
The XLogP value of 4.7887 indicates that 2-(3,4-Dimethoxyphenyl)-3-(3-nitroanilino)inden-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3,4-Dimethoxyphenyl)-3-(3-nitroanilino)inden-1-one. Following Lipinski's Rule of Five, 2-(3,4-Dimethoxyphenyl)-3-(3-nitroanilino)inden-1-one has 1 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 2-(3,4-Dimethoxyphenyl)-3-(3-nitroanilino)inden-1-one?
The CAS number of 2-(3,4-Dimethoxyphenyl)-3-(3-nitroanilino)inden-1-one is 1024119-76-3.
What is the molecular formula of 2-(3,4-Dimethoxyphenyl)-3-(3-nitroanilino)inden-1-one?
The molecular formula of 2-(3,4-Dimethoxyphenyl)-3-(3-nitroanilino)inden-1-one is C23H18N2O5.
What is the molecular weight of 2-(3,4-Dimethoxyphenyl)-3-(3-nitroanilino)inden-1-one?
The molecular weight of 2-(3,4-Dimethoxyphenyl)-3-(3-nitroanilino)inden-1-one is 402.12 g/mol.
Where can I buy 2-(3,4-Dimethoxyphenyl)-3-(3-nitroanilino)inden-1-one?
You can request a quote for 2-(3,4-Dimethoxyphenyl)-3-(3-nitroanilino)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 2-(3,4-Dimethoxyphenyl)-3-(3-nitroanilino)inden-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,4-Dimethoxyphenyl)-3-(3-nitroanilino)inden-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.