propan-2-yl 2-methyl-5-oxo-4-(4-oxo-4H-1-benzopyran-3-yl)-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
propan-2-yl 2-methyl-5-oxo-4-(4-oxo-4H-1-benzopyran-3-yl)-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
propan-2-yl 2-methyl-5-oxo-4-(4-oxo-4H-1-benzopyran-3-yl)-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 4323-7164 |
| Compound Name: | propan-2-yl 2-methyl-5-oxo-4-(4-oxo-4H-1-benzopyran-3-yl)-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 475.56 |
| Molecular Formula: | C27 H25 N O5 S |
| Smiles: | CC(C)OC(C1C(C2=COc3ccccc3C2=O)C2=C(CC(CC2=O)c2cccs2)NC=1C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.7524 |
| logD: | 0.2175 |
| logSw: | -4.6097 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.994 |
| InChI Key: | RGVRSVNSYCTZOW-UHFFFAOYSA-N |