2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-[3-(3-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]acetamide
Chemical Structure Depiction of
2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-[3-(3-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]acetamide
2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-[3-(3-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]acetamide
Compound characteristics
| Compound ID: | G952-3404 |
| Compound Name: | 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-[3-(3-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]acetamide |
| Molecular Weight: | 418.43 |
| Molecular Formula: | C20 H14 N6 O3 S |
| Smiles: | Cc1cccc(c1)c1nnc2n1nc(NC(CN1C(c3ccccc3C1=O)=O)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 2.838 |
| logD: | 2.8376 |
| logSw: | -3.4278 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.436 |
| InChI Key: | XLOGCAHSTGGQTG-UHFFFAOYSA-N |