5-{[3-(3-butoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-(piperidin-1-yl)-1,3-thiazol-4(5H)-one
Chemical Structure Depiction of
5-{[3-(3-butoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-(piperidin-1-yl)-1,3-thiazol-4(5H)-one
5-{[3-(3-butoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-(piperidin-1-yl)-1,3-thiazol-4(5H)-one
Compound characteristics
| Compound ID: | Y070-2181 |
| Compound Name: | 5-{[3-(3-butoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-(piperidin-1-yl)-1,3-thiazol-4(5H)-one |
| Molecular Weight: | 486.64 |
| Molecular Formula: | C28 H30 N4 O2 S |
| Smiles: | CCCCOc1cccc(c1)c1c(/C=C2/C(N=C(N3CCCCC3)S2)=O)cn(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.393 |
| logD: | 6.393 |
| logSw: | -5.5895 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.646 |
| InChI Key: | RDBFQXAQDLRTHE-UHFFFAOYSA-N |