N-butyl-2-[2-(4-butyl-3,5-dimethyl-1H-pyrazol-1-yl)-1,3-thiazol-4-yl]acetamide
Chemical Structure Depiction of
N-butyl-2-[2-(4-butyl-3,5-dimethyl-1H-pyrazol-1-yl)-1,3-thiazol-4-yl]acetamide
N-butyl-2-[2-(4-butyl-3,5-dimethyl-1H-pyrazol-1-yl)-1,3-thiazol-4-yl]acetamide
Compound characteristics
Compound ID: | D351-0691 |
Compound Name: | N-butyl-2-[2-(4-butyl-3,5-dimethyl-1H-pyrazol-1-yl)-1,3-thiazol-4-yl]acetamide |
Molecular Weight: | 348.51 |
Molecular Formula: | C18 H28 N4 O S |
Smiles: | CCCCc1c(C)nn(c1C)c1nc(CC(NCCCC)=O)cs1 |
Stereo: | ACHIRAL |
logP: | 4.2569 |
logD: | 4.2569 |
logSw: | -4.0367 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 49.285 |
InChI Key: | VXRCFTVXYYYXOY-UHFFFAOYSA-N |