10-[(2H-1,3-benzodioxol-5-yl)methyl]-7-methyl-1,2,3,4,10,11-hexahydro-5H,9H-[2]benzopyrano[4,3-g][1,3]benzoxazin-5-one
Chemical Structure Depiction of
10-[(2H-1,3-benzodioxol-5-yl)methyl]-7-methyl-1,2,3,4,10,11-hexahydro-5H,9H-[2]benzopyrano[4,3-g][1,3]benzoxazin-5-one
10-[(2H-1,3-benzodioxol-5-yl)methyl]-7-methyl-1,2,3,4,10,11-hexahydro-5H,9H-[2]benzopyrano[4,3-g][1,3]benzoxazin-5-one
Compound characteristics
| Compound ID: | D144-0652 |
| Compound Name: | 10-[(2H-1,3-benzodioxol-5-yl)methyl]-7-methyl-1,2,3,4,10,11-hexahydro-5H,9H-[2]benzopyrano[4,3-g][1,3]benzoxazin-5-one |
| Molecular Weight: | 405.45 |
| Molecular Formula: | C24 H23 N O5 |
| Smiles: | Cc1c2c(CN(Cc3ccc4c(c3)OCO4)CO2)cc2C3CCCCC=3C(=O)Oc12 |
| Stereo: | ACHIRAL |
| logP: | 4.9351 |
| logD: | 2.9637 |
| logSw: | -4.6338 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.149 |
| InChI Key: | PXOXTYKTBWZMEW-UHFFFAOYSA-N |