Basic information
- Standard SMILES
Cc1ccc(C(=O)c2c(C)n(CCN3CCOCC3)c3ccc(Cl)cc23)c2ccccc12- InChIKey
BUPKLQOLSOARQV-UHFFFAOYSA-N- Molecular formula
- C27H27ClN2O2
- Average molar mass
- 447 g/mol
- Monoisotopic mass
- 446.1761058
Names & identifiers
- Preferred name
- (5-chloro-2-methyl-1-(2-morpholino ethyl)-1H-indol-3-yl)(4-methylnaphthalen-1-yl)methanone
- IUPAC
- [5-chloro-2-methyl-1-(2-morpholin-4-ylethyl)indol-3-yl]-(4-methylnaphthalen-1-yl)methanone
Names & synonyms
SCHEMBL670677CHEMBL5438812BUPKLQOLSOARQV-UHFFFAOYSA-N(5-chloro-2-methyl-1-(2-morpholino ethyl)-1H-indol-3-yl)(4-methylnaphthalen-1-yl)methanone
Database identifiers
- PubChem CID
- 66764962
- ChEMBL
CHEMBL5438812
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 34.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 654
Related reactions
1 records
Compound notes
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