ethyl 4-(3,5-dibromo-4-hydroxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
ethyl 4-(3,5-dibromo-4-hydroxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
ethyl 4-(3,5-dibromo-4-hydroxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 5503-0256 |
| Compound Name: | ethyl 4-(3,5-dibromo-4-hydroxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 513.22 |
| Molecular Formula: | C21 H23 Br2 N O4 |
| Smiles: | CCOC(C1C(C2=C(CC(C)(C)CC2=O)NC=1C)c1cc(c(c(c1)[Br])O)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.579 |
| logD: | 0.2918 |
| logSw: | -4.2376 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.154 |
| InChI Key: | DTMBABSMCKJKFF-KRWDZBQOSA-N |