N~1~-(1-benzylpiperidin-4-yl)-N~4~-[4-(2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]butanediamide
Chemical Structure Depiction of
N~1~-(1-benzylpiperidin-4-yl)-N~4~-[4-(2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]butanediamide
N~1~-(1-benzylpiperidin-4-yl)-N~4~-[4-(2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]butanediamide
Compound characteristics
| Compound ID: | K232-1774 |
| Compound Name: | N~1~-(1-benzylpiperidin-4-yl)-N~4~-[4-(2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]butanediamide |
| Molecular Weight: | 516.62 |
| Molecular Formula: | C28 H28 N4 O4 S |
| Smiles: | C1CN(CCC1NC(CCC(Nc1nc(cs1)C1=Cc2ccccc2OC1=O)=O)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.2211 |
| logD: | 1.6634 |
| logSw: | -3.6451 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.55 |
| InChI Key: | MVYWKDWMJFRCDN-UHFFFAOYSA-N |