N-(1-Benzyl-6,6-dimethyl-2,4-dioxo-3-trifluoromethyl-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)-2,2-dimethyl- propionamide
TL;DR: N-(1-Benzyl-6,6-dimethyl-2,4-dioxo-3-trifluoromethyl-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)-2,2-dimethyl- propionamide (CAS 577695-92-2) is a chemical compound with molecular formula C23H27F3N2O3 and molecular weight 436.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[1-benzyl-6,6-dimethyl-2,4-dioxo-3-(trifluoromethyl)-5,7-dihydroindol-3-yl]-2,2-dimethylpropanamide
Also Known As: N-(1-Benzyl-6,6-dimethyl-2,4-dioxo-3-trifluoromethyl-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)-2,2-dimethyl- propionamide, N-[1-benzyl-6,6-dimethyl-2,4-dioxo-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl]-2,2-dimethylpropanamide, N-[1-benzyl-6,6-dimethyl-2,4-dioxo-3-(trifluoromethyl)-5,7-dihydroindol-3-yl]-2,2-dimethylpropanamide, N-(1-benzyl-6,6-dimethyl-2,4-dioxo-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)pivalamide, N-[1-benzyl-2,4-diketo-6,6-dimethyl-3-(trifluoromethyl)-5,7-dihydroindol-3-yl]-2,2-dimethyl-propionamide
| Molecular Formula | C23H27F3N2O3 |
|---|---|
| Molecular Weight | 436.20 g/mol |
| LogP | 4.1354 |
| Topological Polar Surface Area | 66.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 436.1974 |
| Heavy Atoms | 31 |
| Complexity | 958.51904 |
Chemical Identifiers
| CAS Number | 577695-92-2 |
|---|---|
| SMILES | CC1(CC2=C(C(=O)C1)C(C(=O)N2CC3=CC=CC=C3)(C(F)(F)F)NC(=O)C(C)(C)C)C |
Product Overview
N-(1-Benzyl-6,6-dimethyl-2,4-dioxo-3-trifluoromethyl-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)-2,2-dimethyl- propionamide (CAS 577695-92-2), with molecular formula C23H27F3N2O3 and molecular weight 436.20 g/mol. IUPAC: N-[1-benzyl-6,6-dimethyl-2,4-dioxo-3-(trifluoromethyl)-5,7-dihydroindol-3-yl]-2,2-dimethylpropanamide.
Chemical Property Profile of N-(1-Benzyl-6,6-dimethyl-2,4-dioxo-3-trifluoromethyl-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)-2,2-dimethyl- propionamide
Property Insights of N-(1-Benzyl-6,6-dimethyl-2,4-dioxo-3-trifluoromethyl-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)-2,2-dimethyl- propionamide
The XLogP value of 4.1354 indicates that N-(1-Benzyl-6,6-dimethyl-2,4-dioxo-3-trifluoromethyl-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)-2,2-dimethyl- propionamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.48 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1-Benzyl-6,6-dimethyl-2,4-dioxo-3-trifluoromethyl-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)-2,2-dimethyl- propionamide. Following Lipinski's Rule of Five, N-(1-Benzyl-6,6-dimethyl-2,4-dioxo-3-trifluoromethyl-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)-2,2-dimethyl- propionamide has 1 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 N-(1-Benzyl-6,6-dimethyl-2,4-dioxo-3-trifluoromethyl-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)-2,2-dimethyl- propionamide?
The CAS number of N-(1-Benzyl-6,6-dimethyl-2,4-dioxo-3-trifluoromethyl-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)-2,2-dimethyl- propionamide is 577695-92-2.
What is the molecular formula of N-(1-Benzyl-6,6-dimethyl-2,4-dioxo-3-trifluoromethyl-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)-2,2-dimethyl- propionamide?
The molecular formula of N-(1-Benzyl-6,6-dimethyl-2,4-dioxo-3-trifluoromethyl-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)-2,2-dimethyl- propionamide is C23H27F3N2O3.
What is the molecular weight of N-(1-Benzyl-6,6-dimethyl-2,4-dioxo-3-trifluoromethyl-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)-2,2-dimethyl- propionamide?
The molecular weight of N-(1-Benzyl-6,6-dimethyl-2,4-dioxo-3-trifluoromethyl-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)-2,2-dimethyl- propionamide is 436.20 g/mol.
Where can I buy N-(1-Benzyl-6,6-dimethyl-2,4-dioxo-3-trifluoromethyl-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)-2,2-dimethyl- propionamide?
You can request a quote for N-(1-Benzyl-6,6-dimethyl-2,4-dioxo-3-trifluoromethyl-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)-2,2-dimethyl- propionamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1-Benzyl-6,6-dimethyl-2,4-dioxo-3-trifluoromethyl-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)-2,2-dimethyl- propionamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1-Benzyl-6,6-dimethyl-2,4-dioxo-3-trifluoromethyl-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)-2,2-dimethyl- propionamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.