N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-2H-1,3-benzodioxole-5-carboxamide
N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | Y030-7038 |
| Compound Name: | N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 317.24 |
| Molecular Formula: | C11 H6 F3 N3 O3 S |
| Smiles: | C1Oc2ccc(cc2O1)C(Nc1nnc(C(F)(F)F)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9586 |
| logD: | 0.6088 |
| logSw: | -3.4591 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.99 |
| InChI Key: | DOAWWICODINCIN-UHFFFAOYSA-N |