butane-1,4-diyl bis[4-(2H-1,3-benzodioxol-5-yl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate]
Chemical Structure Depiction of
butane-1,4-diyl bis[4-(2H-1,3-benzodioxol-5-yl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate]
butane-1,4-diyl bis[4-(2H-1,3-benzodioxol-5-yl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate]
Compound characteristics
| Compound ID: | 2524-3755 |
| Compound Name: | butane-1,4-diyl bis[4-(2H-1,3-benzodioxol-5-yl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate] |
| Molecular Weight: | 764.88 |
| Molecular Formula: | C44 H48 N2 O10 |
| Smiles: | CC1=C(C(C2=C(CC(C)(C)CC2=O)N1)c1ccc2c(c1)OCO2)C(=O)OCCCCOC(C1C(C2=C(CC(C)(C)CC2=O)NC=1C)c1ccc2c(c1)OCO2)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.7555 |
| logD: | 2.4684 |
| logSw: | -5.6672 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 123.659 |
| InChI Key: | ZJEATMIYOZOGFA-UHFFFAOYSA-N |