propyl 2,7,7-trimethyl-5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
propyl 2,7,7-trimethyl-5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
propyl 2,7,7-trimethyl-5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 2496-3899 |
| Compound Name: | propyl 2,7,7-trimethyl-5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 359.49 |
| Molecular Formula: | C20 H25 N O3 S |
| Smiles: | CCCOC(C1C(C2=C(CC(C)(C)CC2=O)NC=1C)c1cccs1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0417 |
| logD: | -0.3979 |
| logSw: | -4.0574 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.987 |
| InChI Key: | DJNSUGRTXHCBLI-SFHVURJKSA-N |