N-{3-[butyl(methyl)amino]propyl}-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-{3-[butyl(methyl)amino]propyl}-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
N-{3-[butyl(methyl)amino]propyl}-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide
Compound characteristics
Compound ID: | C857-0183 |
Compound Name: | N-{3-[butyl(methyl)amino]propyl}-1-[5-(1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide |
Molecular Weight: | 404.58 |
Molecular Formula: | C20 H32 N6 O S |
Smiles: | CCCCN(C)CCCNC(C1CCN(CC1)c1nnc(n2cccc2)s1)=O |
Stereo: | ACHIRAL |
logP: | 2.847 |
logD: | 0.25 |
logSw: | -2.8549 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 59.41 |
InChI Key: | JCNDBQUOGQOANI-UHFFFAOYSA-N |