benzyl 4-(benzylamino)-6,7-dimethoxy-2-methyl-3,4-dihydro-2H-quinoline-1-carboxylate
Basic information
- Standard SMILES
COc1cc2c(cc1OC)N(C(=O)OCc1ccccc1)C(C)CC2NCc1ccccc1- InChIKey
DJPKHBPNYQKUTC-UHFFFAOYSA-N- Molecular formula
- C27H30N2O4
- Average molar mass
- 446.5 g/mol
Names & identifiers
- Preferred name
- benzyl 4-(benzylamino)-6,7-dimethoxy-2-methyl-3,4-dihydro-2H-quinoline-1-carboxylate
- IUPAC
- benzyl 4-(benzylamino)-6,7-dimethoxy-2-methyl-3,4-dihydro-2H-quinoline-1-carboxylate
Names & synonyms
SCHEMBL7705619
Database identifiers
- PubChem CID
- 70168751
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 60 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 605
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Related reactions
1 records
Compound notes
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