N-(3,4-dimethoxyphenyl)-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-3-carboxamide
Chemical Structure Depiction of
N-(3,4-dimethoxyphenyl)-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-3-carboxamide
N-(3,4-dimethoxyphenyl)-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-3-carboxamide
Compound characteristics
| Compound ID: | E958-0232 |
| Compound Name: | N-(3,4-dimethoxyphenyl)-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-3-carboxamide |
| Molecular Weight: | 413.5 |
| Molecular Formula: | C20 H23 N5 O3 S |
| Smiles: | COc1ccc(cc1OC)NC(C1CCCN(C1)c1nnc(n2cccc2)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7413 |
| logD: | 2.7411 |
| logSw: | -3.3599 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.096 |
| InChI Key: | DOXGALHYGNRJAH-AWEZNQCLSA-N |