Basic information
- Standard SMILES
Cc1c(Cc2ccccc2)nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(N3CCOCC3)cc21- InChIKey
OCZOBJJJHVJDCI-UHFFFAOYSA-N- Molecular formula
- C30H30F2N4O
- Average molar mass
- 500.6 g/mol
Names & identifiers
- Preferred name
- 2-benzyl-4-(3,3-dimethyl-6-(4-morpholinyl)-2,3-dihydro-1H-pyrrolo[3,2-b]pyridin-1-yl)-5,7-difluoro-3-methylquinoline
- IUPAC
- 4-[1-(2-benzyl-5,7-difluoro-3-methylquinolin-4-yl)-3,3-dimethyl-2H-pyrrolo[3,2-b]pyridin-6-yl]morpholine
Names & synonyms
SCHEMBL2124226CHEMBL3698350OCZOBJJJHVJDCI-UHFFFAOYSA-NBDBM1247272-benzyl-4-(3,3-dimethyl-6-(4-morpholinyl)-2,3-dihydro-1H-pyrrolo[3,2-b]pyridin-1-yl)-5,7-difluoro-3-methylquinolineUS8765940, 2-benzyl-4-(3,3-dimethyl-6-(4-morpholinyl)-2,3-dihydro-1H-pyrrolo[3,2-b]pyridin-1-yl)-5,7-difluoro-3-methylquinoline
Database identifiers
- PubChem CID
- 50939733
- ChEMBL
CHEMBL3698350
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 41.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 773
Related reactions
1 records
Compound notes
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