3-[(2H-1,3-benzodioxol-5-yl)methyl]-7-ethyl-6,10-dimethyl-3,4-dihydro-2H,8H-pyrano[3,2-g][1,3]benzoxazin-8-one
Chemical Structure Depiction of
3-[(2H-1,3-benzodioxol-5-yl)methyl]-7-ethyl-6,10-dimethyl-3,4-dihydro-2H,8H-pyrano[3,2-g][1,3]benzoxazin-8-one
3-[(2H-1,3-benzodioxol-5-yl)methyl]-7-ethyl-6,10-dimethyl-3,4-dihydro-2H,8H-pyrano[3,2-g][1,3]benzoxazin-8-one
Compound characteristics
| Compound ID: | D144-0649 |
| Compound Name: | 3-[(2H-1,3-benzodioxol-5-yl)methyl]-7-ethyl-6,10-dimethyl-3,4-dihydro-2H,8H-pyrano[3,2-g][1,3]benzoxazin-8-one |
| Molecular Weight: | 393.44 |
| Molecular Formula: | C23 H23 N O5 |
| Smiles: | CCC1=C(C)c2cc3CN(Cc4ccc5c(c4)OCO5)COc3c(C)c2OC1=O |
| Stereo: | ACHIRAL |
| logP: | 4.7192 |
| logD: | 2.7478 |
| logSw: | -4.5442 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.229 |
| InChI Key: | FEEQPVYXPQMYTP-UHFFFAOYSA-N |