N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[5-(phenylcarbamoyl)-1,3,4-thiadiazole-2-carbonyl]piperidine-3-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[5-(phenylcarbamoyl)-1,3,4-thiadiazole-2-carbonyl]piperidine-3-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[5-(phenylcarbamoyl)-1,3,4-thiadiazole-2-carbonyl]piperidine-3-carboxamide
Compound characteristics
| Compound ID: | F864-0499 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[5-(phenylcarbamoyl)-1,3,4-thiadiazole-2-carbonyl]piperidine-3-carboxamide |
| Molecular Weight: | 493.54 |
| Molecular Formula: | C24 H23 N5 O5 S |
| Smiles: | C1CC(CN(C1)C(c1nnc(C(Nc2ccccc2)=O)s1)=O)C(NCc1ccc2c(c1)OCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0842 |
| logD: | 2.0834 |
| logSw: | -2.9082 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 104.944 |
| InChI Key: | PZHPSWGGVKDASJ-INIZCTEOSA-N |