Basic information
- Standard SMILES
Cc1c(C=C2C(=O)Nc3cccc(-c4cccc(F)c4F)c32)[nH]c2c1C(=O)N(CC(O)CN1CCOCC1)CC2- InChIKey
FRYBKHUIKIJRHQ-UHFFFAOYSA-N- Molecular formula
- C30H30F2N4O4
- Average molar mass
- 548.6 g/mol
- Monoisotopic mass
- 548.22351178
Names & identifiers
- Preferred name
- 2-[[4-(2,3-difluorophenyl)-2-oxo-1H-indol-3-ylidene]methyl]-5-(2-hydroxy-3-morpholin-4-ylpropyl)-3-methyl-6,7-dihydro-1H-pyrrolo[3,2-c]pyridin-4-one
- IUPAC
- 2-[[4-(2,3-difluorophenyl)-2-oxo-1H-indol-3-ylidene]methyl]-5-(2-hydroxy-3-morpholin-4-ylpropyl)-3-methyl-6,7-dihydro-1H-pyrrolo[3,2-c]pyridin-4-one
Names & synonyms
SCHEMBL2780576
Database identifiers
- PubChem CID
- 67531991
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 97.9 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 977
Related reactions
2 records
Compound notes
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