Basic information
- Standard SMILES
Cc1[nH]c(C=C2C(=O)Nc3cccc(-c4ccc(Br)cc4)c32)c(C)c1C(=O)N1CC(C)NC(C)C1- InChIKey
FTSWGMJOXYBIAU-UHFFFAOYSA-N- Molecular formula
- C28H29BrN4O2
- Average molar mass
- 533.5 g/mol
Names & identifiers
- Preferred name
- 4-(4-bromophenyl)-3-[[4-(3,5-dimethylpiperazine-1-carbonyl)-3,5-dimethyl-1H-pyrrol-2-yl]methylidene]-1H-indol-2-one
- IUPAC
- 4-(4-bromophenyl)-3-[[4-(3,5-dimethylpiperazine-1-carbonyl)-3,5-dimethyl-1H-pyrrol-2-yl]methylidene]-1H-indol-2-one
Names & synonyms
SCHEMBL6766050
Database identifiers
- PubChem CID
- 69890491
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 77.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 831
Related reactions
1 records
Compound notes
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