1-(4-Chloro-3-nitrophenyl)-2,6-dimethyl-5,6,7-trihydroindol-4-one
TL;DR: 1-(4-Chloro-3-nitrophenyl)-2,6-dimethyl-5,6,7-trihydroindol-4-one (CAS 1022675-06-4) is a chemical compound with molecular formula C16H15ClN2O3 and molecular weight 318.07712 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-chloro-3-nitrophenyl)-2,6-dimethyl-6,7-dihydro-5H-indol-4-one
Also Known As: 1-(4-CHLORO-3-NITROPHENYL)-2,6-DIMETHYL-5,6,7-TRIHYDROINDOL-4-ONE, 1-(4-chloro-3-nitrophenyl)-2,6-dimethyl-4,5,6,7-tetrahydro-1H-indol-4-one, 1-(4-chloro-3-nitrophenyl)-2,6-dimethyl-6,7-dihydro-5H-indol-4-one, 1-(4-chloro-3-nitro-phenyl)-2,6-dimethyl-6,7-dihydro-5H-indol-4-one, 1-(4-Chloro-3-nitrophenyl)-2,6-dimethyl-1,5,6,7-tetrahydro-4H-indol-4-one
Technical Specifications
| Molecular Formula | C16H15ClN2O3 |
| Molecular Weight | 318.07712 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 67.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 318.07712 Da |
| Heavy Atoms | 22 |
| Complexity | 467.0 |
| SMILES | CC1CC2=C(C=C(N2C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C)C(=O)C1 |
| InChIKey | VPHXPJWNBNQFPN-UHFFFAOYSA-N |
Chemical Property Profile of 1-(4-Chloro-3-nitrophenyl)-2,6-dimethyl-5,6,7-trihydroindol-4-one
Property Insights of 1-(4-Chloro-3-nitrophenyl)-2,6-dimethyl-5,6,7-trihydroindol-4-one
The XLogP value of 3.8 indicates that 1-(4-Chloro-3-nitrophenyl)-2,6-dimethyl-5,6,7-trihydroindol-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Chloro-3-nitrophenyl)-2,6-dimethyl-5,6,7-trihydroindol-4-one. Following Lipinski's Rule of Five, 1-(4-Chloro-3-nitrophenyl)-2,6-dimethyl-5,6,7-trihydroindol-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
What is the CAS number of 1-(4-Chloro-3-nitrophenyl)-2,6-dimethyl-5,6,7-trihydroindol-4-one?
The CAS number of 1-(4-Chloro-3-nitrophenyl)-2,6-dimethyl-5,6,7-trihydroindol-4-one is 1022675-06-4.
What is the molecular formula of 1-(4-Chloro-3-nitrophenyl)-2,6-dimethyl-5,6,7-trihydroindol-4-one?
The molecular formula of 1-(4-Chloro-3-nitrophenyl)-2,6-dimethyl-5,6,7-trihydroindol-4-one is C16H15ClN2O3.
What is the molecular weight of 1-(4-Chloro-3-nitrophenyl)-2,6-dimethyl-5,6,7-trihydroindol-4-one?
The molecular weight of 1-(4-Chloro-3-nitrophenyl)-2,6-dimethyl-5,6,7-trihydroindol-4-one is 318.07712 g/mol.
Where can I buy 1-(4-Chloro-3-nitrophenyl)-2,6-dimethyl-5,6,7-trihydroindol-4-one?
You can request a quote for 1-(4-Chloro-3-nitrophenyl)-2,6-dimethyl-5,6,7-trihydroindol-4-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(4-Chloro-3-nitrophenyl)-2,6-dimethyl-5,6,7-trihydroindol-4-one?
Yes, CoreyChem provides custom synthesis services for 1-(4-Chloro-3-nitrophenyl)-2,6-dimethyl-5,6,7-trihydroindol-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.