5-(4-oxo-4H-3,1-benzoxazin-2-yl)-2-[(pyridin-3-yl)methyl]-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
5-(4-oxo-4H-3,1-benzoxazin-2-yl)-2-[(pyridin-3-yl)methyl]-1H-isoindole-1,3(2H)-dione
5-(4-oxo-4H-3,1-benzoxazin-2-yl)-2-[(pyridin-3-yl)methyl]-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 2922-1822 |
| Compound Name: | 5-(4-oxo-4H-3,1-benzoxazin-2-yl)-2-[(pyridin-3-yl)methyl]-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 383.36 |
| Molecular Formula: | C22 H13 N3 O4 |
| Smiles: | C(c1cccnc1)N1C(c2ccc(cc2C1=O)C1=Nc2ccccc2C(=O)O1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3523 |
| logD: | 2.3523 |
| logSw: | -3.1484 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.956 |
| InChI Key: | FIWAUSUQRLTCQO-UHFFFAOYSA-N |