Basic information
- Standard SMILES
CCN(CC)CCOc1ccc2c(c1)C(C)(C)c1[nH]c3cc(Cl)ccc3c1C2=O- InChIKey
CMXGMXGQJOXSFO-UHFFFAOYSA-N- Molecular formula
- C24H27ClN2O2
- Average molar mass
- 410.9 g/mol
Names & identifiers
- Preferred name
- 3-Chloro-8-(2-diethylaminoethoxy)-6,6-dimethyl-5,6-dihydro-benzo[b]carbazol-11-one
- IUPAC
- 3-chloro-8-[2-(diethylamino)ethoxy]-6,6-dimethyl-5H-benzo[b]carbazol-11-one
Names & synonyms
CHEMBL1779191SCHEMBL898504CMXGMXGQJOXSFO-UHFFFAOYSA-NBDBM503446533-chloro-8-(2-(diethylamino)ethoxy)-6,6-dimethyl-5H-benzo[b]carbazol-11(6H)-one3-Chloro-8-(2-diethylaminoethoxy)-6,6-dimethyl-5,6-dihydro-benzo[b]carbazol-11-one
Database identifiers
- PubChem CID
- 54580866
- ChEMBL
CHEMBL1779191
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 45.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 593
Related reactions
2 records
Compound notes
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