N-(3-chloro-2-methylphenyl)-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
N-(3-chloro-2-methylphenyl)-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | C857-0069 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide |
| Molecular Weight: | 401.92 |
| Molecular Formula: | C19 H20 Cl N5 O S |
| Smiles: | Cc1c(cccc1[Cl])NC(C1CCN(CC1)c1nnc(n2cccc2)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3298 |
| logD: | 4.3286 |
| logSw: | -4.3547 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.204 |
| InChI Key: | XCOIJRDSXSLZKK-UHFFFAOYSA-N |