1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]-N-[3-(propylsulfanyl)propyl]piperidine-4-carboxamide
Chemical Structure Depiction of
1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]-N-[3-(propylsulfanyl)propyl]piperidine-4-carboxamide
1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]-N-[3-(propylsulfanyl)propyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | C857-1967 |
| Compound Name: | 1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]-N-[3-(propylsulfanyl)propyl]piperidine-4-carboxamide |
| Molecular Weight: | 421.63 |
| Molecular Formula: | C20 H31 N5 O S2 |
| Smiles: | CCCSCCCNC(C1CCN(CC1)c1nnc(n2c(C)ccc2C)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1972 |
| logD: | 3.1972 |
| logSw: | -3.052 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.24 |
| InChI Key: | XHQSHBUYCQUIOI-UHFFFAOYSA-N |