methyl (9-benzyl-4-methyl-2-oxo-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-3-yl)acetate
Chemical Structure Depiction of
methyl (9-benzyl-4-methyl-2-oxo-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-3-yl)acetate
methyl (9-benzyl-4-methyl-2-oxo-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-3-yl)acetate
Compound characteristics
| Compound ID: | D144-0098 |
| Compound Name: | methyl (9-benzyl-4-methyl-2-oxo-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-3-yl)acetate |
| Molecular Weight: | 379.41 |
| Molecular Formula: | C22 H21 N O5 |
| Smiles: | CC1=C(CC(=O)OC)C(=O)Oc2c1ccc1c2CN(Cc2ccccc2)CO1 |
| Stereo: | ACHIRAL |
| logP: | 3.4822 |
| logD: | 3.3091 |
| logSw: | -3.7289 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.008 |
| InChI Key: | ORIXZHZFROOQEB-UHFFFAOYSA-N |