9-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(4-methoxyphenyl)-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Chemical Structure Depiction of
9-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(4-methoxyphenyl)-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
9-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(4-methoxyphenyl)-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Compound characteristics
| Compound ID: | D144-0281 |
| Compound Name: | 9-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(4-methoxyphenyl)-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one |
| Molecular Weight: | 443.46 |
| Molecular Formula: | C26 H21 N O6 |
| Smiles: | COc1ccc(cc1)C1=CC(=O)Oc2c1ccc1c2CN(Cc2ccc3c(c2)OCO3)CO1 |
| Stereo: | ACHIRAL |
| logP: | 4.4255 |
| logD: | 4.1473 |
| logSw: | -4.4179 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.302 |
| InChI Key: | FXUGSZFBABTMQC-UHFFFAOYSA-N |