Basic information
- Standard SMILES
COC(=O)CCCCNC(=O)c1c(C)[nH]c(C=NN=C2C(=O)Nc3ccc(F)cc32)c1C- InChIKey
GDEZBBBHAPHDRR-UHFFFAOYSA-N- Molecular formula
- C22H24FN5O4
- Average molar mass
- 441.5 g/mol
Names & identifiers
- Preferred name
- 5-(5-(((5-fluoro-2-oxoindolin-3-ylidene)hydrazono)methyl)-2,4-dimethyl-1H-pyrrole-3-carboxamido)-pentanoic acid methyl ester
- IUPAC
- methyl 5-[[5-[[(5-fluoro-2-oxo-1H-indol-3-ylidene)hydrazinylidene]methyl]-2,4-dimethyl-1H-pyrrole-3-carbonyl]amino]pentanoate
Names & synonyms
SCHEMBL4416837GDEZBBBHAPHDRR-UHFFFAOYSA-N5-(5-(((5-fluoro-2-oxoindolin-3-ylidene)hydrazono)methyl)-2,4-dimethyl-1H-pyrrole-3-carboxamido)-pentanoic acid methyl ester
Database identifiers
- PubChem CID
- 136387946
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 125 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 9
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 773
Related reactions
4 records
Compound notes
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