N-{2-[ethyl(phenyl)amino]ethyl}-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-{2-[ethyl(phenyl)amino]ethyl}-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
N-{2-[ethyl(phenyl)amino]ethyl}-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
Compound characteristics
Compound ID: | C857-0201 |
Compound Name: | N-{2-[ethyl(phenyl)amino]ethyl}-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide |
Molecular Weight: | 424.57 |
Molecular Formula: | C22 H28 N6 O S |
Smiles: | CCN(CCNC(C1CCN(CC1)c1nnc(n2cccc2)s1)=O)c1ccccc1 |
Stereo: | ACHIRAL |
logP: | 3.5494 |
logD: | 3.5452 |
logSw: | -3.4463 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.055 |
InChI Key: | BKIZLTPTKMVSOZ-UHFFFAOYSA-N |