1-{5-[(2H-1,3-benzodioxol-5-yl)carbamoyl]-1,3,4-thiadiazole-2-carbonyl}-N-(2-methylphenyl)piperidine-4-carboxamide
Chemical Structure Depiction of
1-{5-[(2H-1,3-benzodioxol-5-yl)carbamoyl]-1,3,4-thiadiazole-2-carbonyl}-N-(2-methylphenyl)piperidine-4-carboxamide
1-{5-[(2H-1,3-benzodioxol-5-yl)carbamoyl]-1,3,4-thiadiazole-2-carbonyl}-N-(2-methylphenyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | F863-0736 |
| Compound Name: | 1-{5-[(2H-1,3-benzodioxol-5-yl)carbamoyl]-1,3,4-thiadiazole-2-carbonyl}-N-(2-methylphenyl)piperidine-4-carboxamide |
| Molecular Weight: | 493.54 |
| Molecular Formula: | C24 H23 N5 O5 S |
| Smiles: | Cc1ccccc1NC(C1CCN(CC1)C(c1nnc(C(Nc2ccc3c(c2)OCO3)=O)s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5104 |
| logD: | 2.4957 |
| logSw: | -2.8694 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 102.991 |
| InChI Key: | SMKPYPMWJWAWOL-UHFFFAOYSA-N |