2-Indolinone, 3-(2-(diethylamino)ethyl)-1-((2,3-dimethoxybenzyl)methylamino)-3-phenyl-
Basic information
- CAS
40714-43-0- Standard SMILES
CCN(CC)CCC1(c2ccccc2)C(=O)N(N(C)Cc2cccc(OC)c2OC)c2ccccc21- InChIKey
QAHNYLOWHSOTJP-UHFFFAOYSA-N- Molecular formula
- C30H37N3O3
- Average molar mass
- 487.6 g/mol
- Monoisotopic mass
- 487.28349205
Names & identifiers
- Preferred name
- 2-Indolinone, 3-(2-(diethylamino)ethyl)-1-((2,3-dimethoxybenzyl)methylamino)-3-phenyl-
- IUPAC
- 3-[2-(diethylamino)ethyl]-1-[(2,3-dimethoxyphenyl)methyl-methylamino]-3-phenylindol-2-one
- English name
- 3-(2-Diethylaminoethyl)-1-[(2,3-dimethoxybenzyl)methylamino]-3-phenyl-2-indolinone
- Molecular formula
- C30H37N3O3
- Molecular weight
- 487.63
Names & synonyms
40714-43-0BRN 04658542-Indolinone, 3-(2-(diethylamino)ethyl)-1-((2,3-dimethoxybenzyl)methylamino)-3-phenyl-3-(2-(Diethylamino)ethyl)-1-((2,3-dimethoxybenzyl)methylamino)-3-phenyl-2-indolinoneDTXSID609611283-(2-Diethylaminoethyl)-1-[(2,3-dimethoxybenzyl)methylamino]-3-phenyl-2-indolinone3-[2-(diethylamino)ethyl]-1-[(2,3-dimethoxybenzyl)(methyl)amino]-3-phenyl-1,3-dihydro-2H-indol-2-one3-[2-(Diethylamino)ethyl]-1-{[(2,3-dimethoxyphenyl)methyl](methyl)amino}-3-phenyl-1,3-dihydro-2H-indol-2-one3-(2-diethylamino-ethyl)-1-[(2,3-dimethoxy-benzyl)-methyl-amino]-3-phenyl-1,3-dihydro-indol-2-one2H-Indol-2-one, 3-[2-(diethylamino)ethyl]-1-[[(2,3-dimethoxyphenyl)methyl]methylamino]-1,3-dihydro-3-phenyl-
Database identifiers
- CAS
40714-43-0- PubChem CID
- 38642
- DTXSID
DTXSID60961128- Nikkaji
- J68.739A
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 45.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 11
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 695
Physicochemical properties
- Boiling point
- 584.2 · 584.2±60.0 °C(Predicted)
- Density
- 1.18 · 1.18±0.1 g/cm3(Predicted)
- pka
- 10.17 · 10.17±0.25(Predicted)
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Compound notes
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