2-[4-(benzenesulfonyl)piperazin-1-yl]-5-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methylidene]-1,3-thiazol-4(5H)-one
Chemical Structure Depiction of
2-[4-(benzenesulfonyl)piperazin-1-yl]-5-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methylidene]-1,3-thiazol-4(5H)-one
2-[4-(benzenesulfonyl)piperazin-1-yl]-5-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methylidene]-1,3-thiazol-4(5H)-one
Compound characteristics
| Compound ID: | Y505-7270 |
| Compound Name: | 2-[4-(benzenesulfonyl)piperazin-1-yl]-5-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methylidene]-1,3-thiazol-4(5H)-one |
| Molecular Weight: | 445.56 |
| Molecular Formula: | C20 H23 N5 O3 S2 |
| Smiles: | CCn1cc(/C=C2/C(N=C(N3CCN(CC3)S(c3ccccc3)(=O)=O)S2)=O)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.8881 |
| logD: | 1.8881 |
| logSw: | -2.3317 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 71.969 |
| InChI Key: | VXHPZBJFVZQPGS-UHFFFAOYSA-N |