N-(3,4-dimethoxyphenyl)-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-(3,4-dimethoxyphenyl)-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
N-(3,4-dimethoxyphenyl)-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | C857-0027 |
| Compound Name: | N-(3,4-dimethoxyphenyl)-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide |
| Molecular Weight: | 413.5 |
| Molecular Formula: | C20 H23 N5 O3 S |
| Smiles: | COc1ccc(cc1OC)NC(C1CCN(CC1)c1nnc(n2cccc2)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7587 |
| logD: | 2.7586 |
| logSw: | -3.3518 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.163 |
| InChI Key: | ZIKUCLVLFOLVCG-UHFFFAOYSA-N |