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8-(5-(((5-fluoro-2-oxoindolin-3-ylidene)hydrazono)methyl)-2,4-dimethyl-1H-pyrrole-3-carboxamido)-N-(2-aminophenyl)octanamide

HCID 136387975
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
Cc1[nH]c(C=NN=C2C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NCCCCCCCC(=O)Nc1ccccc1N
InChIKey
ONXYFTFXCNTHOJ-UHFFFAOYSA-N
Molecular formula
C30H34FN7O3
Average molar mass
559.6 g/mol

Names & identifiers

Preferred name
8-(5-(((5-fluoro-2-oxoindolin-3-ylidene)hydrazono)methyl)-2,4-dimethyl-1H-pyrrole-3-carboxamido)-N-(2-aminophenyl)octanamide
IUPAC
N-[8-(2-aminoanilino)-8-oxooctyl]-5-[[(5-fluoro-2-oxo-1H-indol-3-ylidene)hydrazinylidene]methyl]-2,4-dimethyl-1H-pyrrole-3-carboxamide

Names & synonyms

SCHEMBL4408623ONXYFTFXCNTHOJ-UHFFFAOYSA-N8-(5-(((5-fluoro-2-oxoindolin-3-ylidene)hydrazono)methyl)-2,4-dimethyl-1H-pyrrole-3-carboxamido)-N-(2-aminophenyl)octanamide

Database identifiers

PubChem CID
136387975

Properties

Computed structural properties

XLogP
4.2
Topological polar surface area
154 Ų
Hydrogen bond donors
5
Hydrogen bond acceptors
7
Rotatable bonds
12
Heavy atoms
41
Formal charge
0
Complexity
976

Related reactions

1 records
New reaction record
HRID 251682 reaction equation
HRID 251682As productuspto-grants-2011_01

Compound notes

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