Basic information
- Standard SMILES
Cc1cc(C(=O)NCCN2CCCCC2)c(/C=C2\C(=O)Nc3cccc(-c4cccc(F)c4)c32)[nH]1- InChIKey
HOCGTFBMSKZONP-QJOMJCCJSA-N- Molecular formula
- C28H29FN4O2
- Average molar mass
- 472.6 g/mol
Names & identifiers
- Preferred name
- 2-[4-(3-Fluoro-phenyl)-2-oxo-1,2-dihydro-indol-(3Z)-ylidenemethyl]-5-methyl-1H-pyrrole-3-carboxylic acid (2-Piperidin-1-yl-ethyl)-amide
- IUPAC
- 2-[(Z)-[4-(3-fluorophenyl)-2-oxo-1H-indol-3-ylidene]methyl]-5-methyl-N-(2-piperidin-1-ylethyl)-1H-pyrrole-3-carboxamide
Names & synonyms
HOCGTFBMSKZONP-QJOMJCCJSA-N2-[4-(3-Fluoro-phenyl)-2-oxo-1,2-dihydro-indol-(3Z)-ylidenemethyl]-5-methyl-1H-pyrrole-3-carboxylic acid (2-Piperidin-1-yl-ethyl)-amide2-[4-(3-Fluoro-phenyl)-2-oxo-1,2-dihydro-indol-(3Z)-ylidenemethyl]-5-methyl-1H-pyrrole-3-carboxylic acid (2-piperidin-1-ylethyl)amide2-[4-(3-Fluorophenyl)-2-oxo-1,2-dihydro-indol-(3Z)-ylidenemethyl]-5-methyl-1H-pyrrole-3-carboxylic acid (2-piperidin-1-yl-ethyl)-amide
Database identifiers
- PubChem CID
- 60061591
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 77.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 798
Related reactions
2 records
Compound notes
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