1-(4-{5-[(4-methyl-1H-pyrazol-1-yl)methyl]-1,2-oxazole-3-carbonyl}piperazin-1-yl)but-2-yn-1-one
Chemical Structure Depiction of
1-(4-{5-[(4-methyl-1H-pyrazol-1-yl)methyl]-1,2-oxazole-3-carbonyl}piperazin-1-yl)but-2-yn-1-one
1-(4-{5-[(4-methyl-1H-pyrazol-1-yl)methyl]-1,2-oxazole-3-carbonyl}piperazin-1-yl)but-2-yn-1-one
Compound characteristics
| Compound ID: | T002-0279 |
| Compound Name: | 1-(4-{5-[(4-methyl-1H-pyrazol-1-yl)methyl]-1,2-oxazole-3-carbonyl}piperazin-1-yl)but-2-yn-1-one |
| Molecular Weight: | 341.37 |
| Molecular Formula: | C17 H19 N5 O3 |
| Smiles: | CC#CC(N1CCN(CC1)C(c1cc(Cn2cc(C)cn2)on1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9835 |
| logD: | 0.9835 |
| logSw: | -1.2344 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 68.57 |
| InChI Key: | GVSJJRQLMOFMLV-UHFFFAOYSA-N |