1-(5-{2-[(4-ethoxyanilino)methyl]-1H-pyrrol-1-yl}-1,3,4-thiadiazol-2-yl)-N-(3-methylbutyl)piperidine-4-carboxamide
Chemical Structure Depiction of
1-(5-{2-[(4-ethoxyanilino)methyl]-1H-pyrrol-1-yl}-1,3,4-thiadiazol-2-yl)-N-(3-methylbutyl)piperidine-4-carboxamide
1-(5-{2-[(4-ethoxyanilino)methyl]-1H-pyrrol-1-yl}-1,3,4-thiadiazol-2-yl)-N-(3-methylbutyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | C794-1432 |
| Compound Name: | 1-(5-{2-[(4-ethoxyanilino)methyl]-1H-pyrrol-1-yl}-1,3,4-thiadiazol-2-yl)-N-(3-methylbutyl)piperidine-4-carboxamide |
| Molecular Weight: | 496.67 |
| Molecular Formula: | C26 H36 N6 O2 S |
| Smiles: | CCOc1ccc(cc1)NCc1cccn1c1nnc(N2CCC(CC2)C(NCCC(C)C)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.9838 |
| logD: | 4.9838 |
| logSw: | -4.286 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.239 |
| InChI Key: | AVIXANBECLTVSK-UHFFFAOYSA-N |