Indole, 3-(3H-indol-3-ylidenemethyl)-

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Basic information

CAS: 526-32-9
Standard SMILES: C1=Nc2ccccc2/C1=C/c1c[nH]c2ccccc12
InChIKey: DBWOMMLCMHIBTN-UKTHLTGXSA-N
Molecular formula: C17H12N2
Average molar mass: 244.29 g/mol
Monoisotopic mass: 244.10004839

Names & identifiers

Preferred name: Indole, 3-(3H-indol-3-ylidenemethyl)-
IUPAC: (3Z)-3-(1H-indol-3-ylmethylidene)indole

Names & synonyms

Indole, 3-(3H-indol-3-ylidenemethyl)-NSC76746NSC 76746CHEMBL1900086NSC-76746NCGC00184060-01NCGC00184060-02(3Z)-3-(1H-indol-3-ylmethylene)indole1H-Indole, 3-[(Z)-3H-indol-3-ylidenemethyl]-

Database identifiers

CAS: 526-32-9
PubChem CID: 5484362
ChEMBL: CHEMBL1900086

Properties

Computed structural properties

XLogP: 3.3
Topological polar surface area: 28.2 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 1
Heavy atoms: 19
Formal charge: 0
Complexity: 398

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Compound notes

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