9-[(3,4-dimethoxyphenyl)methyl]-4-phenyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Chemical Structure Depiction of
9-[(3,4-dimethoxyphenyl)methyl]-4-phenyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
9-[(3,4-dimethoxyphenyl)methyl]-4-phenyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Compound characteristics
| Compound ID: | D144-0226 |
| Compound Name: | 9-[(3,4-dimethoxyphenyl)methyl]-4-phenyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one |
| Molecular Weight: | 429.47 |
| Molecular Formula: | C26 H23 N O5 |
| Smiles: | COc1ccc(CN2Cc3c(ccc4C(=CC(=O)Oc34)c3ccccc3)OC2)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.0398 |
| logD: | 3.7616 |
| logSw: | -4.3719 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.904 |
| InChI Key: | PKVKPQYTTIINDJ-UHFFFAOYSA-N |