1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]-N-[(3,4,5-triethoxyphenyl)methyl]piperidine-3-carboxamide
Chemical Structure Depiction of
1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]-N-[(3,4,5-triethoxyphenyl)methyl]piperidine-3-carboxamide
1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]-N-[(3,4,5-triethoxyphenyl)methyl]piperidine-3-carboxamide
Compound characteristics
| Compound ID: | E958-0398 |
| Compound Name: | 1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]-N-[(3,4,5-triethoxyphenyl)methyl]piperidine-3-carboxamide |
| Molecular Weight: | 499.63 |
| Molecular Formula: | C25 H33 N5 O4 S |
| Smiles: | CCOc1cc(CNC(C2CCCN(C2)c2nnc(n3cccc3)s2)=O)cc(c1OCC)OCC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6356 |
| logD: | 3.6356 |
| logSw: | -3.7401 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.875 |
| InChI Key: | HSXWYMAOHWYUPI-IBGZPJMESA-N |