2,8-dimethyl-5-(2-(1-methyl-1H-indol-5-yl)cyclopent-1-enyl)-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole
Basic information
- Standard SMILES
Cc1ccc2c(c1)c1c(n2C2=C(c3ccc4c(ccn4C)c3)CCC2)CCN(C)C1- InChIKey
OOIBIMQCZNJWQQ-UHFFFAOYSA-N- Molecular formula
- C27H29N3
- Average molar mass
- 395.5 g/mol
Names & identifiers
- Preferred name
- 2,8-dimethyl-5-(2-(1-methyl-1H-indol-5-yl)cyclopent-1-enyl)-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole
- IUPAC
- 2,8-dimethyl-5-[2-(1-methylindol-5-yl)cyclopenten-1-yl]-3,4-dihydro-1H-pyrido[4,3-b]indole
Names & synonyms
SCHEMBL12481037OOIBIMQCZNJWQQ-UHFFFAOYSA-N2,8-dimethyl-5-(2-(1-methyl-1H-indol-5-yl)cyclopent-1-enyl)-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole
Database identifiers
- PubChem CID
- 68284366
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 13.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 686
Related reactions
3 records
Compound notes
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