4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-2,7,7-trimethyl-3-(morpholine-4-carbonyl)-4,6,7,8-tetrahydroquinolin-5(1H)-one
Chemical Structure Depiction of
4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-2,7,7-trimethyl-3-(morpholine-4-carbonyl)-4,6,7,8-tetrahydroquinolin-5(1H)-one
4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-2,7,7-trimethyl-3-(morpholine-4-carbonyl)-4,6,7,8-tetrahydroquinolin-5(1H)-one
Compound characteristics
| Compound ID: | K836-0344 |
| Compound Name: | 4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-2,7,7-trimethyl-3-(morpholine-4-carbonyl)-4,6,7,8-tetrahydroquinolin-5(1H)-one |
| Molecular Weight: | 485.54 |
| Molecular Formula: | C25 H31 N3 O7 |
| Smiles: | CCOc1cc(cc(c1O)[N+]([O-])=O)C1C(=C(C)NC2CC(C)(C)CC(C1=2)=O)C(N1CCOCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9218 |
| logD: | -0.5857 |
| logSw: | -3.4058 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 104.248 |
| InChI Key: | CFWYNVXCYPBIRV-NRFANRHFSA-N |