2-(4-benzylpiperidin-1-yl)-5-[(4-chlorophenyl)methylidene]-1,3-thiazol-4(5H)-one
Chemical Structure Depiction of
2-(4-benzylpiperidin-1-yl)-5-[(4-chlorophenyl)methylidene]-1,3-thiazol-4(5H)-one
2-(4-benzylpiperidin-1-yl)-5-[(4-chlorophenyl)methylidene]-1,3-thiazol-4(5H)-one
Compound characteristics
| Compound ID: | 8013-7681 |
| Compound Name: | 2-(4-benzylpiperidin-1-yl)-5-[(4-chlorophenyl)methylidene]-1,3-thiazol-4(5H)-one |
| Molecular Weight: | 396.94 |
| Molecular Formula: | C22 H21 Cl N2 O S |
| Smiles: | C1CN(CCC1Cc1ccccc1)C1=NC(/C(=C\c2ccc(cc2)[Cl])S1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.763 |
| logD: | 5.763 |
| logSw: | -6.2784 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 25.3236 |
| InChI Key: | KXSARXUCUHIRCA-UHFFFAOYSA-N |