2-(4-benzylpiperazin-1-yl)-5-[(4-butoxy-3-methoxyphenyl)methylidene]-1,3-thiazol-4(5H)-one
Chemical Structure Depiction of
2-(4-benzylpiperazin-1-yl)-5-[(4-butoxy-3-methoxyphenyl)methylidene]-1,3-thiazol-4(5H)-one
2-(4-benzylpiperazin-1-yl)-5-[(4-butoxy-3-methoxyphenyl)methylidene]-1,3-thiazol-4(5H)-one
Compound characteristics
| Compound ID: | Y070-1360 |
| Compound Name: | 2-(4-benzylpiperazin-1-yl)-5-[(4-butoxy-3-methoxyphenyl)methylidene]-1,3-thiazol-4(5H)-one |
| Molecular Weight: | 465.61 |
| Molecular Formula: | C26 H31 N3 O3 S |
| Smiles: | CCCCOc1ccc(/C=C2/C(N=C(N3CCN(CC3)Cc3ccccc3)S2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.6074 |
| logD: | 4.4452 |
| logSw: | -4.3824 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 44.27 |
| InChI Key: | XCTWXDDBISAIPU-UHFFFAOYSA-N |