N-(2H-1,3-benzodioxol-5-yl)-4-phenyl-1,2,3-thiadiazole-5-carboxamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-4-phenyl-1,2,3-thiadiazole-5-carboxamide
N-(2H-1,3-benzodioxol-5-yl)-4-phenyl-1,2,3-thiadiazole-5-carboxamide
Compound characteristics
| Compound ID: | Y042-4136 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-4-phenyl-1,2,3-thiadiazole-5-carboxamide |
| Molecular Weight: | 325.34 |
| Molecular Formula: | C16 H11 N3 O3 S |
| Smiles: | C1Oc2ccc(cc2O1)NC(c1c(c2ccccc2)nns1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0771 |
| logD: | 3.0768 |
| logSw: | -3.4518 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.811 |
| InChI Key: | JSSDVXUEPQOODQ-UHFFFAOYSA-N |