3-benzyl-4-methyl-9-[(4-methylphenyl)methyl]-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Chemical Structure Depiction of
3-benzyl-4-methyl-9-[(4-methylphenyl)methyl]-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
3-benzyl-4-methyl-9-[(4-methylphenyl)methyl]-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Compound characteristics
| Compound ID: | E754-0655 |
| Compound Name: | 3-benzyl-4-methyl-9-[(4-methylphenyl)methyl]-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one |
| Molecular Weight: | 411.5 |
| Molecular Formula: | C27 H25 N O3 |
| Smiles: | CC1=C(Cc2ccccc2)C(=O)Oc2c1ccc1c2CN(Cc2ccc(C)cc2)CO1 |
| Stereo: | ACHIRAL |
| logP: | 5.842 |
| logD: | 5.4105 |
| logSw: | -5.6168 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.157 |
| InChI Key: | AVESFHFBJQQCHD-UHFFFAOYSA-N |