1-{[(4-phenyl-5-sulfanylidene-4,5-dihydro-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl}piperidine-4-carboxamide
Chemical Structure Depiction of
1-{[(4-phenyl-5-sulfanylidene-4,5-dihydro-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl}piperidine-4-carboxamide
1-{[(4-phenyl-5-sulfanylidene-4,5-dihydro-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl}piperidine-4-carboxamide
Compound characteristics
| Compound ID: | Y020-1175 |
| Compound Name: | 1-{[(4-phenyl-5-sulfanylidene-4,5-dihydro-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl}piperidine-4-carboxamide |
| Molecular Weight: | 394.53 |
| Molecular Formula: | C16 H18 N4 O2 S3 |
| Smiles: | C1CN(CCC1C(N)=O)C(CSC1=NN(C(=S)S1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.082 |
| logD: | 2.0819 |
| logSw: | -2.443 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.639 |
| InChI Key: | VYBGILFNJJVPDC-UHFFFAOYSA-N |