N-[(1-benzyl-2-oxo-1,3,4,5,6,7-hexahydroquinolin-4a(2H)-yl)methyl]quinoline-2-carboxamide
Chemical Structure Depiction of
N-[(1-benzyl-2-oxo-1,3,4,5,6,7-hexahydroquinolin-4a(2H)-yl)methyl]quinoline-2-carboxamide
N-[(1-benzyl-2-oxo-1,3,4,5,6,7-hexahydroquinolin-4a(2H)-yl)methyl]quinoline-2-carboxamide
Compound characteristics
| Compound ID: | S570-0710 |
| Compound Name: | N-[(1-benzyl-2-oxo-1,3,4,5,6,7-hexahydroquinolin-4a(2H)-yl)methyl]quinoline-2-carboxamide |
| Molecular Weight: | 425.53 |
| Molecular Formula: | C27 H27 N3 O2 |
| Smiles: | C1CC=C2C(C1)(CCC(N2Cc1ccccc1)=O)CNC(c1ccc2ccccc2n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2824 |
| logD: | 5.2824 |
| logSw: | -6.0409 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.374 |
| InChI Key: | XOMHLGIWXVORPL-MHZLTWQESA-N |