N-(6,6-dimethyl-2,4-dioxo-1-((tetrahydrofuran-2-yl)methyl)-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)furan-2-carboxamide
TL;DR: N-(6,6-dimethyl-2,4-dioxo-1-((tetrahydrofuran-2-yl)methyl)-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)furan-2-carboxamide (CAS 577761-89-8) is a chemical compound with molecular formula C21H23F3N2O5 and molecular weight 440.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[6,6-dimethyl-2,4-dioxo-1-(oxolan-2-ylmethyl)-3-(trifluoromethyl)-5,7-dihydroindol-3-yl]furan-2-carboxamide
Also Known As: N-(6,6-dimethyl-2,4-dioxo-1-((tetrahydrofuran-2-yl)methyl)-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)furan-2-carboxamide, N-[6,6-dimethyl-2,4-dioxo-1-(oxolan-2-ylmethyl)-3-(trifluoromethyl)-5,7-dihydroindol-3-yl]furan-2-carboxamide, N-[6,6-dimethyl-2,4-dioxo-1-(tetrahydrofuran-2-ylmethyl)-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl]furan-2-carboxamide
| Molecular Formula | C21H23F3N2O5 |
|---|---|
| Molecular Weight | 440.16 g/mol |
| LogP | 2.9749 |
| Topological Polar Surface Area | 88.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 440.1559 |
| Heavy Atoms | 31 |
| Complexity | 944.71655 |
Chemical Identifiers
| CAS Number | 577761-89-8 |
|---|---|
| SMILES | CC1(CC2=C(C(=O)C1)C(C(=O)N2CC3CCCO3)(C(F)(F)F)NC(=O)C4=CC=CO4)C |
Product Overview
N-(6,6-dimethyl-2,4-dioxo-1-((tetrahydrofuran-2-yl)methyl)-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)furan-2-carboxamide (CAS 577761-89-8), with molecular formula C21H23F3N2O5 and molecular weight 440.16 g/mol. IUPAC: N-[6,6-dimethyl-2,4-dioxo-1-(oxolan-2-ylmethyl)-3-(trifluoromethyl)-5,7-dihydroindol-3-yl]furan-2-carboxamide.
Chemical Property Profile of N-(6,6-dimethyl-2,4-dioxo-1-((tetrahydrofuran-2-yl)methyl)-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)furan-2-carboxamide
Property Insights of N-(6,6-dimethyl-2,4-dioxo-1-((tetrahydrofuran-2-yl)methyl)-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)furan-2-carboxamide
The XLogP value of 2.9749 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(6,6-dimethyl-2,4-dioxo-1-((tetrahydrofuran-2-yl)methyl)-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)furan-2-carboxamide. The TPSA of 88.85 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(6,6-dimethyl-2,4-dioxo-1-((tetrahydrofuran-2-yl)methyl)-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)furan-2-carboxamide. Following Lipinski's Rule of Five, N-(6,6-dimethyl-2,4-dioxo-1-((tetrahydrofuran-2-yl)methyl)-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)furan-2-carboxamide has 1 hydrogen bond donor(s) and 5 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-(6,6-dimethyl-2,4-dioxo-1-((tetrahydrofuran-2-yl)methyl)-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)furan-2-carboxamide?
The CAS number of N-(6,6-dimethyl-2,4-dioxo-1-((tetrahydrofuran-2-yl)methyl)-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)furan-2-carboxamide is 577761-89-8.
What is the molecular formula of N-(6,6-dimethyl-2,4-dioxo-1-((tetrahydrofuran-2-yl)methyl)-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)furan-2-carboxamide?
The molecular formula of N-(6,6-dimethyl-2,4-dioxo-1-((tetrahydrofuran-2-yl)methyl)-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)furan-2-carboxamide is C21H23F3N2O5.
What is the molecular weight of N-(6,6-dimethyl-2,4-dioxo-1-((tetrahydrofuran-2-yl)methyl)-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)furan-2-carboxamide?
The molecular weight of N-(6,6-dimethyl-2,4-dioxo-1-((tetrahydrofuran-2-yl)methyl)-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)furan-2-carboxamide is 440.16 g/mol.
Where can I buy N-(6,6-dimethyl-2,4-dioxo-1-((tetrahydrofuran-2-yl)methyl)-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)furan-2-carboxamide?
You can request a quote for N-(6,6-dimethyl-2,4-dioxo-1-((tetrahydrofuran-2-yl)methyl)-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)furan-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(6,6-dimethyl-2,4-dioxo-1-((tetrahydrofuran-2-yl)methyl)-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)furan-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(6,6-dimethyl-2,4-dioxo-1-((tetrahydrofuran-2-yl)methyl)-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)furan-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.