2-methoxy-4-(3,3,6,6-tetramethyl-1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)phenyl N-(2H-1,3-benzodioxol-5-yl)glycinate
Chemical Structure Depiction of
2-methoxy-4-(3,3,6,6-tetramethyl-1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)phenyl N-(2H-1,3-benzodioxol-5-yl)glycinate
2-methoxy-4-(3,3,6,6-tetramethyl-1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)phenyl N-(2H-1,3-benzodioxol-5-yl)glycinate
Compound characteristics
| Compound ID: | 3031-1457 |
| Compound Name: | 2-methoxy-4-(3,3,6,6-tetramethyl-1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)phenyl N-(2H-1,3-benzodioxol-5-yl)glycinate |
| Molecular Weight: | 573.64 |
| Molecular Formula: | C33 H35 N O8 |
| Smiles: | CC1(C)CC2=C(C(C3=C(CC(C)(C)CC3=O)O2)c2ccc(c(c2)OC)OC(CNc2ccc3c(c2)OCO3)=O)C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7656 |
| logD: | 4.7656 |
| logSw: | -4.7783 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.519 |
| InChI Key: | VEWYYFUKWNFISH-UHFFFAOYSA-N |