2,7,7-trimethyl-N-(4-methylpyridin-2-yl)-4-(3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide
Chemical Structure Depiction of
2,7,7-trimethyl-N-(4-methylpyridin-2-yl)-4-(3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide
2,7,7-trimethyl-N-(4-methylpyridin-2-yl)-4-(3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide
Compound characteristics
Compound ID: | 3716-0348 |
Compound Name: | 2,7,7-trimethyl-N-(4-methylpyridin-2-yl)-4-(3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide |
Molecular Weight: | 446.51 |
Molecular Formula: | C25 H26 N4 O4 |
Smiles: | CC1=C(C(C2=C(CC(C)(C)CC2=O)N1)c1cccc(c1)[N+]([O-])=O)C(Nc1cc(C)ccn1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.9983 |
logD: | 1.9686 |
logSw: | -4.1633 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 90.009 |
InChI Key: | XIVLEHXAVUIIQI-QFIPXVFZSA-N |