2-{[6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-1,3-benzothiazol-2-yl]sulfanyl}-N-(4-methoxy-2-nitrophenyl)acetamide
Chemical Structure Depiction of
2-{[6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-1,3-benzothiazol-2-yl]sulfanyl}-N-(4-methoxy-2-nitrophenyl)acetamide
2-{[6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-1,3-benzothiazol-2-yl]sulfanyl}-N-(4-methoxy-2-nitrophenyl)acetamide
Compound characteristics
| Compound ID: | 8009-1626 |
| Compound Name: | 2-{[6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-1,3-benzothiazol-2-yl]sulfanyl}-N-(4-methoxy-2-nitrophenyl)acetamide |
| Molecular Weight: | 520.54 |
| Molecular Formula: | C24 H16 N4 O6 S2 |
| Smiles: | COc1ccc(c(c1)[N+]([O-])=O)NC(CSc1nc2ccc(cc2s1)N1C(c2ccccc2C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8868 |
| logD: | 4.8629 |
| logSw: | -4.6657 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 100.766 |
| InChI Key: | STKDEYXVBMDKAN-UHFFFAOYSA-N |