3-(2-(Diethylamino)ethyl)-3-phenyl-1-((o-trifluoromethylbenzyl)methylamino)-2-indolinone
Basic information
- CAS
40714-09-8- Standard SMILES
CCN(CC)CCC1(c2ccccc2)C(=O)N(N(C)Cc2ccccc2C(F)(F)F)c2ccccc21- InChIKey
XTSLUTSCLFJVIK-UHFFFAOYSA-N- Molecular formula
- C29H32F3N3O
- Average molar mass
- 495.6 g/mol
- Monoisotopic mass
- 495.24974714
Names & identifiers
- Preferred name
- 3-(2-(Diethylamino)ethyl)-3-phenyl-1-((o-trifluoromethylbenzyl)methylamino)-2-indolinone
- IUPAC
- 3-[2-(diethylamino)ethyl]-1-[methyl-[[2-(trifluoromethyl)phenyl]methyl]amino]-3-phenylindol-2-one
Names & synonyms
3-(2-(Diethylamino)ethyl)-3-phenyl-1-((o-trifluoromethylbenzyl)methylamino)-2-indolinone40714-09-8BRN 04667202-Indolinone, 3-(2-(diethylamino)ethyl)-3-phenyl-1-((o-trifluoromethylbenzyl)methylamino)-DTXSID209611243-[2-(Diethylamino)ethyl]-1-(methyl{[2-(trifluoromethyl)phenyl]methyl}amino)-3-phenyl-1,3-dihydro-2H-indol-2-one
Database identifiers
- CAS
40714-09-8- PubChem CID
- 38637
- DTXSID
DTXSID20961124
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 26.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 721
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Compound notes
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