5-(1,3-benzoxazol-2-yl)-2-{4-[(4-nitrophenyl)sulfanyl]phenyl}-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
5-(1,3-benzoxazol-2-yl)-2-{4-[(4-nitrophenyl)sulfanyl]phenyl}-1H-isoindole-1,3(2H)-dione
5-(1,3-benzoxazol-2-yl)-2-{4-[(4-nitrophenyl)sulfanyl]phenyl}-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 2372-3599 |
| Compound Name: | 5-(1,3-benzoxazol-2-yl)-2-{4-[(4-nitrophenyl)sulfanyl]phenyl}-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 493.5 |
| Molecular Formula: | C27 H15 N3 O5 S |
| Smiles: | c1ccc2c(c1)nc(c1ccc3C(N(C(c3c1)=O)c1ccc(cc1)Sc1ccc(cc1)[N+]([O-])=O)=O)o2 |
| Stereo: | ACHIRAL |
| logP: | 6.6214 |
| logD: | 6.6214 |
| logSw: | -6.1879 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 78.8 |
| InChI Key: | VZPKSJVSMXZHKY-UHFFFAOYSA-N |