2-{[3-(thiophen-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]methyl}-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-{[3-(thiophen-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]methyl}-1H-isoindole-1,3(2H)-dione
2-{[3-(thiophen-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]methyl}-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | D727-0142 |
| Compound Name: | 2-{[3-(thiophen-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]methyl}-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 367.41 |
| Molecular Formula: | C16 H9 N5 O2 S2 |
| Smiles: | C(c1nn2c(c3cccs3)nnc2s1)N1C(c2ccccc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3588 |
| logD: | 2.3588 |
| logSw: | -2.8564 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.76 |
| InChI Key: | DELVAAIAHCDTBY-UHFFFAOYSA-N |