N-(2H-1,3-benzodioxol-5-yl)-5-[4-(pyrrolidine-1-carbonyl)piperidine-1-carbonyl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-5-[4-(pyrrolidine-1-carbonyl)piperidine-1-carbonyl]-1,3,4-thiadiazole-2-carboxamide
N-(2H-1,3-benzodioxol-5-yl)-5-[4-(pyrrolidine-1-carbonyl)piperidine-1-carbonyl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F863-0735 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-5-[4-(pyrrolidine-1-carbonyl)piperidine-1-carbonyl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 457.51 |
| Molecular Formula: | C21 H23 N5 O5 S |
| Smiles: | C1CCN(C1)C(C1CCN(CC1)C(c1nnc(C(Nc2ccc3c(c2)OCO3)=O)s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8037 |
| logD: | 1.789 |
| logSw: | -2.6587 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.612 |
| InChI Key: | HRWORWINFNMAML-UHFFFAOYSA-N |