N-[(4-butoxyphenyl)methyl]-1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-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-4-carboxamide
N-[(4-butoxyphenyl)methyl]-1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | C857-2047 |
| Compound Name: | N-[(4-butoxyphenyl)methyl]-1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide |
| Molecular Weight: | 467.63 |
| Molecular Formula: | C25 H33 N5 O2 S |
| Smiles: | CCCCOc1ccc(CNC(C2CCN(CC2)c2nnc(n3c(C)ccc3C)s2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.4814 |
| logD: | 4.4814 |
| logSw: | -4.0106 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.545 |
| InChI Key: | ZOPOVPXCOLKBCS-UHFFFAOYSA-N |