2,6-dimethyl-1-(3-nitrophenyl)-6,7-dihydro-5H-indol-4-one
TL;DR: 2,6-dimethyl-1-(3-nitrophenyl)-6,7-dihydro-5H-indol-4-one (CAS 1024446-69-2) is a chemical compound with molecular formula C16H16N2O3 and molecular weight 284.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-dimethyl-1-(3-nitrophenyl)-6,7-dihydro-5H-indol-4-one
Also Known As: 2,6-dimethyl-1-(3-nitrophenyl)-6,7-dihydro-5H-indol-4-one, 2,6-DIMETHYL-1-(3-NITROPHENYL)-5,6,7-TRIHYDROINDOL-4-ONE, 2,6-dimethyl-1-(3-nitrophenyl)-4,5,6,7-tetrahydro-1H-indol-4-one
| Molecular Formula | C16H16N2O3 |
|---|---|
| Molecular Weight | 284.12 g/mol |
| LogP | 3.45892 |
| Topological Polar Surface Area | 65.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 284.1161 |
| Heavy Atoms | 21 |
| Complexity | 745.9755 |
Chemical Identifiers
| CAS Number | 1024446-69-2 |
|---|---|
| SMILES | CC1CC2=C(C=C(N2C3=CC(=CC=C3)[N+](=O)[O-])C)C(=O)C1 |
Product Overview
2,6-dimethyl-1-(3-nitrophenyl)-6,7-dihydro-5H-indol-4-one (CAS 1024446-69-2), with molecular formula C16H16N2O3 and molecular weight 284.12 g/mol. IUPAC: 2,6-dimethyl-1-(3-nitrophenyl)-6,7-dihydro-5H-indol-4-one.
Chemical Property Profile of 2,6-dimethyl-1-(3-nitrophenyl)-6,7-dihydro-5H-indol-4-one
Property Insights of 2,6-dimethyl-1-(3-nitrophenyl)-6,7-dihydro-5H-indol-4-one
The XLogP value of 3.45892 indicates that 2,6-dimethyl-1-(3-nitrophenyl)-6,7-dihydro-5H-indol-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.14 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,6-dimethyl-1-(3-nitrophenyl)-6,7-dihydro-5H-indol-4-one. Following Lipinski's Rule of Five, 2,6-dimethyl-1-(3-nitrophenyl)-6,7-dihydro-5H-indol-4-one has 0 hydrogen bond donor(s) and 3 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 2,6-dimethyl-1-(3-nitrophenyl)-6,7-dihydro-5H-indol-4-one?
The CAS number of 2,6-dimethyl-1-(3-nitrophenyl)-6,7-dihydro-5H-indol-4-one is 1024446-69-2.
What is the molecular formula of 2,6-dimethyl-1-(3-nitrophenyl)-6,7-dihydro-5H-indol-4-one?
The molecular formula of 2,6-dimethyl-1-(3-nitrophenyl)-6,7-dihydro-5H-indol-4-one is C16H16N2O3.
What is the molecular weight of 2,6-dimethyl-1-(3-nitrophenyl)-6,7-dihydro-5H-indol-4-one?
The molecular weight of 2,6-dimethyl-1-(3-nitrophenyl)-6,7-dihydro-5H-indol-4-one is 284.12 g/mol.
Where can I buy 2,6-dimethyl-1-(3-nitrophenyl)-6,7-dihydro-5H-indol-4-one?
You can request a quote for 2,6-dimethyl-1-(3-nitrophenyl)-6,7-dihydro-5H-indol-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-dimethyl-1-(3-nitrophenyl)-6,7-dihydro-5H-indol-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2,6-dimethyl-1-(3-nitrophenyl)-6,7-dihydro-5H-indol-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.