Basic information
- Standard SMILES
Cc1cc(N2CC=C(C(=O)OC(C)C)CC2)c2cccc(-c3ccc(Cl)cc3Cl)c2n1- InChIKey
YSNWRAAJCSCDLM-UHFFFAOYSA-N- Molecular formula
- C25H24Cl2N2O2
- Average molar mass
- 455.4 g/mol
Names & identifiers
- Preferred name
- 8-(2,4-Dichlorophenyl)-4-(4-isopropyloxycarbonyl-1,2,3,6-tetrahydropyridin-1-yl)-2-methylquinoline
- IUPAC
- propan-2-yl 1-[8-(2,4-dichlorophenyl)-2-methylquinolin-4-yl]-3,6-dihydro-2H-pyridine-4-carboxylate
Names & synonyms
SCHEMBL5249524YSNWRAAJCSCDLM-UHFFFAOYSA-N8-(2,4-dichlorophenyl)-4-(4-isopropyloxycarbonyl-1,2,3,6-tetrahydropyridin-1-yl)-2-methylquinoline
Database identifiers
- PubChem CID
- 12134673
Properties
Computed structural properties
- XLogP
- 6.7
- Topological polar surface area
- 42.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 670
Related reactions
3 records
Compound notes
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