N-[(4-methylphenyl)methyl]-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-3-carboxamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-3-carboxamide
N-[(4-methylphenyl)methyl]-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-3-carboxamide
Compound characteristics
| Compound ID: | C857-0348 |
| Compound Name: | N-[(4-methylphenyl)methyl]-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-3-carboxamide |
| Molecular Weight: | 381.5 |
| Molecular Formula: | C20 H23 N5 O S |
| Smiles: | Cc1ccc(CNC(C2CCCN(C2)c2nnc(n3cccc3)s2)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3187 |
| logD: | 3.3187 |
| logSw: | -3.3321 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.157 |
| InChI Key: | TXRINVHCRUPNLJ-KRWDZBQOSA-N |