4-(3-bromo-4-hydroxy-5-methoxyphenyl)-2,7,7-trimethyl-3-(morpholine-4-carbonyl)-4,6,7,8-tetrahydroquinolin-5(1H)-one
Chemical Structure Depiction of
4-(3-bromo-4-hydroxy-5-methoxyphenyl)-2,7,7-trimethyl-3-(morpholine-4-carbonyl)-4,6,7,8-tetrahydroquinolin-5(1H)-one
4-(3-bromo-4-hydroxy-5-methoxyphenyl)-2,7,7-trimethyl-3-(morpholine-4-carbonyl)-4,6,7,8-tetrahydroquinolin-5(1H)-one
Compound characteristics
| Compound ID: | K836-0256 |
| Compound Name: | 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-2,7,7-trimethyl-3-(morpholine-4-carbonyl)-4,6,7,8-tetrahydroquinolin-5(1H)-one |
| Molecular Weight: | 505.41 |
| Molecular Formula: | C24 H29 Br N2 O5 |
| Smiles: | CC1=C(C(C2=C(CC(C)(C)CC2=O)N1)c1cc(c(c(c1)[Br])O)OC)C(N1CCOCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6369 |
| logD: | -0.8706 |
| logSw: | -2.8108 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.588 |
| InChI Key: | YBPWGMYPMJIFNA-FQEVSTJZSA-N |