3-benzyl-9-[2-(3,4-dimethoxyphenyl)ethyl]-4-methyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Chemical Structure Depiction of
3-benzyl-9-[2-(3,4-dimethoxyphenyl)ethyl]-4-methyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
3-benzyl-9-[2-(3,4-dimethoxyphenyl)ethyl]-4-methyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Compound characteristics
| Compound ID: | E754-0661 |
| Compound Name: | 3-benzyl-9-[2-(3,4-dimethoxyphenyl)ethyl]-4-methyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one |
| Molecular Weight: | 471.55 |
| Molecular Formula: | C29 H29 N O5 |
| Smiles: | CC1=C(Cc2ccccc2)C(=O)Oc2c1ccc1c2CN(CCc2ccc(c(c2)OC)OC)CO1 |
| Stereo: | ACHIRAL |
| logP: | 5.116 |
| logD: | 4.9297 |
| logSw: | -5.091 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.396 |
| InChI Key: | CAKWEUJQAFHJHB-UHFFFAOYSA-N |