3-benzyl-9-[(3-methoxyphenyl)methyl]-4-methyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Chemical Structure Depiction of
3-benzyl-9-[(3-methoxyphenyl)methyl]-4-methyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
3-benzyl-9-[(3-methoxyphenyl)methyl]-4-methyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Compound characteristics
| Compound ID: | E754-0656 |
| Compound Name: | 3-benzyl-9-[(3-methoxyphenyl)methyl]-4-methyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one |
| Molecular Weight: | 427.5 |
| Molecular Formula: | C27 H25 N O4 |
| Smiles: | CC1=C(Cc2ccccc2)C(=O)Oc2c1ccc1c2CN(Cc2cccc(c2)OC)CO1 |
| Stereo: | ACHIRAL |
| logP: | 5.474 |
| logD: | 4.3065 |
| logSw: | -5.549 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.701 |
| InChI Key: | YQRRFRZFWIMLCO-UHFFFAOYSA-N |