9-benzyl-3,4-dimethyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Chemical Structure Depiction of
9-benzyl-3,4-dimethyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
9-benzyl-3,4-dimethyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Compound characteristics
| Compound ID: | Y040-1663 |
| Compound Name: | 9-benzyl-3,4-dimethyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one |
| Molecular Weight: | 321.37 |
| Molecular Formula: | C20 H19 N O3 |
| Smiles: | CC1=C(C)c2ccc3c(CN(Cc4ccccc4)CO3)c2OC1=O |
| Stereo: | ACHIRAL |
| logP: | 3.9812 |
| logD: | 3.8081 |
| logSw: | -4.326 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.429 |
| InChI Key: | OCEDPFKHBQSGOV-UHFFFAOYSA-N |