N~1~-[4-(8-ethoxy-2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]-N~4~-[2-(2-methylpiperidin-1-yl)ethyl]butanediamide
Chemical Structure Depiction of
N~1~-[4-(8-ethoxy-2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]-N~4~-[2-(2-methylpiperidin-1-yl)ethyl]butanediamide
N~1~-[4-(8-ethoxy-2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]-N~4~-[2-(2-methylpiperidin-1-yl)ethyl]butanediamide
Compound characteristics
| Compound ID: | K232-1905 |
| Compound Name: | N~1~-[4-(8-ethoxy-2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]-N~4~-[2-(2-methylpiperidin-1-yl)ethyl]butanediamide |
| Molecular Weight: | 512.63 |
| Molecular Formula: | C26 H32 N4 O5 S |
| Smiles: | CCOc1cccc2C=C(C(=O)Oc12)c1csc(NC(CCC(NCCN2CCCCC2C)=O)=O)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5173 |
| logD: | 0.5444 |
| logSw: | -2.9242 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.453 |
| InChI Key: | PSYBZZMVOOQGIC-KRWDZBQOSA-N |