cyclopentyl 2-methyl-4-(6-methyl-4-oxo-4H-1-benzopyran-3-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
cyclopentyl 2-methyl-4-(6-methyl-4-oxo-4H-1-benzopyran-3-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
cyclopentyl 2-methyl-4-(6-methyl-4-oxo-4H-1-benzopyran-3-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 3004-4897 |
| Compound Name: | cyclopentyl 2-methyl-4-(6-methyl-4-oxo-4H-1-benzopyran-3-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 433.5 |
| Molecular Formula: | C26 H27 N O5 |
| Smiles: | CC1=C(C(C2=COc3ccc(C)cc3C2=O)C2=C(CCCC2=O)N1)C(=O)OC1CCCC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1406 |
| logD: | 0.0559 |
| logSw: | -4.2996 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.264 |
| InChI Key: | IXLRRQNNBCKPEE-QHCPKHFHSA-N |