ethyl 4-(3,5-dichlorothiophen-2-yl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
ethyl 4-(3,5-dichlorothiophen-2-yl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
ethyl 4-(3,5-dichlorothiophen-2-yl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 8005-2690 |
| Compound Name: | ethyl 4-(3,5-dichlorothiophen-2-yl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 414.35 |
| Molecular Formula: | C19 H21 Cl2 N O3 S |
| Smiles: | CCOC(C1C(C2=C(CC(C)(C)CC2=O)NC=1C)c1c(cc(s1)[Cl])[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9628 |
| logD: | 0.6864 |
| logSw: | -5.0114 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.693 |
| InChI Key: | SBBDGIPSNGVLON-INIZCTEOSA-N |