2-methyl-4-(4-methyl-3-nitrophenyl)-3-(morpholine-4-carbonyl)-4,6,7,8-tetrahydroquinolin-5(1H)-one
Chemical Structure Depiction of
2-methyl-4-(4-methyl-3-nitrophenyl)-3-(morpholine-4-carbonyl)-4,6,7,8-tetrahydroquinolin-5(1H)-one
2-methyl-4-(4-methyl-3-nitrophenyl)-3-(morpholine-4-carbonyl)-4,6,7,8-tetrahydroquinolin-5(1H)-one
Compound characteristics
Compound ID: | K836-0302 |
Compound Name: | 2-methyl-4-(4-methyl-3-nitrophenyl)-3-(morpholine-4-carbonyl)-4,6,7,8-tetrahydroquinolin-5(1H)-one |
Molecular Weight: | 411.46 |
Molecular Formula: | C22 H25 N3 O5 |
Smiles: | CC1=C(C(C2=C(CCCC2=O)N1)c1ccc(C)c(c1)[N+]([O-])=O)C(N1CCOCC1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.4143 |
logD: | -0.702 |
logSw: | -2.9067 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 81.559 |
InChI Key: | QQNPKADHMMJIPE-FQEVSTJZSA-N |