N-[(4-butoxyphenyl)methyl]-1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-3-carboxamide
Chemical Structure Depiction of
N-[(4-butoxyphenyl)methyl]-1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-3-carboxamide
N-[(4-butoxyphenyl)methyl]-1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-3-carboxamide
Compound characteristics
| Compound ID: | C857-2288 |
| Compound Name: | N-[(4-butoxyphenyl)methyl]-1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-3-carboxamide |
| Molecular Weight: | 467.63 |
| Molecular Formula: | C25 H33 N5 O2 S |
| Smiles: | CCCCOc1ccc(CNC(C2CCCN(C2)c2nnc(n3c(C)ccc3C)s2)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.464 |
| logD: | 4.464 |
| logSw: | -4.0729 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.478 |
| InChI Key: | YXLWROIFQZLHHT-NRFANRHFSA-N |