5-{[3-(3,4-dimethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-(piperidin-1-yl)-1,3-thiazol-4(5H)-one
Chemical Structure Depiction of
5-{[3-(3,4-dimethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-(piperidin-1-yl)-1,3-thiazol-4(5H)-one
5-{[3-(3,4-dimethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-(piperidin-1-yl)-1,3-thiazol-4(5H)-one
Compound characteristics
Compound ID: | Y070-1335 |
Compound Name: | 5-{[3-(3,4-dimethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-(piperidin-1-yl)-1,3-thiazol-4(5H)-one |
Molecular Weight: | 474.58 |
Molecular Formula: | C26 H26 N4 O3 S |
Smiles: | COc1ccc(cc1OC)c1c(/C=C2/C(N=C(N3CCCCC3)S2)=O)cn(c2ccccc2)n1 |
Stereo: | ACHIRAL |
logP: | 4.5043 |
logD: | 4.5043 |
logSw: | -4.2881 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 55.489 |
InChI Key: | BSAIFORBIWYCRE-UHFFFAOYSA-N |