Basic information
- Standard SMILES
CCn1c(C)c(C2(c3c(C)n(CC)c4c3ccc3ccccc34)OC(=O)c3c(Cl)c(Cl)c(Cl)c(Cl)c32)c2ccccc21- InChIKey
ZSBTWSQEFGZDGU-UHFFFAOYSA-N- Molecular formula
- C34H26Cl4N2O2
- Average molar mass
- 636.4 g/mol
- Monoisotopic mass
- 634.074839
Names & identifiers
- Preferred name
- 3-(1-ethyl-2-methylindol-3-yl)-3-(1-ethyl-2-methyl-1H-benz[g]indol-3-yl)-4,5,6,7-tetrachlorophthalide
- IUPAC
- 4,5,6,7-tetrachloro-3-(1-ethyl-2-methylbenzo[g]indol-3-yl)-3-(1-ethyl-2-methylindol-3-yl)-2-benzofuran-1-one
Names & synonyms
SCHEMBL11721164ZSBTWSQEFGZDGU-UHFFFAOYSA-N3-(1-ethyl-2-methylindol-3-yl)-3-(1-ethyl-2-methyl-1H-benz[g]indol-3-yl)-4,5,6,7-tetrachlorophthalide
Database identifiers
- PubChem CID
- 21444096
Properties
Computed structural properties
- XLogP
- 9.8
- Topological polar surface area
- 36.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 1,030
Related reactions
1 records
Compound notes
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