Propyl 4-(2,4-dichlorophenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Basic information
- CAS
5711-33-1- Standard SMILES
CCCOC(=O)C1=C(C)NC2=C(C(=O)CC(c3ccccc3)C2)C1c1ccc(Cl)cc1Cl- InChIKey
LTGXTXHVJKDGOT-UHFFFAOYSA-N- Molecular formula
- C26H25Cl2NO3
- Average molar mass
- 470.4 g/mol
- Monoisotopic mass
- 469.121149
Names & identifiers
- Preferred name
- Propyl 4-(2,4-dichlorophenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
- IUPAC
- propyl 4-(2,4-dichlorophenyl)-2-methyl-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Names & synonyms
5711-33-1GNF-Pf-5324propyl 4-(2,4-dichlorophenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylatepropyl 4-(2,4-dichlorophenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylateOprea1_218171propyl 4-(2,4-dichlorophenyl)-2-methyl-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylateCHEMBL579171SCHEMBL3323592DTXSID70386469STK363695AKOS001610814AKOS021988769
Show more names
ST017293SR-01000424118SR-01000424118-1propyl 4-(2,4-dichlorophenyl)-2-methyl-5-oxo-7-phenyl-1,4,6,7,8-pentahydroquin oline-3-carboxylate
Database identifiers
- CAS
5711-33-1- PubChem CID
- 2863771
- DTXSID
DTXSID70386469- ChEMBL
CHEMBL579171
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 799
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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