N-(2H-1,3-benzodioxol-5-yl)-5-[1-(3-fluorobenzoyl)piperidin-4-yl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-5-[1-(3-fluorobenzoyl)piperidin-4-yl]-1,3,4-thiadiazole-2-carboxamide
N-(2H-1,3-benzodioxol-5-yl)-5-[1-(3-fluorobenzoyl)piperidin-4-yl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | L076-0941 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-5-[1-(3-fluorobenzoyl)piperidin-4-yl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 454.48 |
| Molecular Formula: | C22 H19 F N4 O4 S |
| Smiles: | C1CN(CCC1c1nnc(C(Nc2ccc3c(c2)OCO3)=O)s1)C(c1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9859 |
| logD: | 2.985 |
| logSw: | -3.3603 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.326 |
| InChI Key: | KDKBVYMMWDCJTP-UHFFFAOYSA-N |