5-(1,3-benzoxazol-2-yl)-2-(4-nitrophenyl)-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
5-(1,3-benzoxazol-2-yl)-2-(4-nitrophenyl)-1H-isoindole-1,3(2H)-dione
5-(1,3-benzoxazol-2-yl)-2-(4-nitrophenyl)-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 8008-2495 |
| Compound Name: | 5-(1,3-benzoxazol-2-yl)-2-(4-nitrophenyl)-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 385.33 |
| Molecular Formula: | C21 H11 N3 O5 |
| Smiles: | c1ccc2c(c1)nc(c1ccc3C(N(C(c3c1)=O)c1ccc(cc1)[N+]([O-])=O)=O)o2 |
| Stereo: | ACHIRAL |
| logP: | 4.3719 |
| logD: | 4.3719 |
| logSw: | -4.6472 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 79.072 |
| InChI Key: | XXPZHLYXVDOURG-UHFFFAOYSA-N |