N~1~-[4-(6-chloro-2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]-N~4~-[2-(2-chlorophenyl)ethyl]butanediamide
Chemical Structure Depiction of
N~1~-[4-(6-chloro-2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]-N~4~-[2-(2-chlorophenyl)ethyl]butanediamide
N~1~-[4-(6-chloro-2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]-N~4~-[2-(2-chlorophenyl)ethyl]butanediamide
Compound characteristics
| Compound ID: | K232-1840 |
| Compound Name: | N~1~-[4-(6-chloro-2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]-N~4~-[2-(2-chlorophenyl)ethyl]butanediamide |
| Molecular Weight: | 516.4 |
| Molecular Formula: | C24 H19 Cl2 N3 O4 S |
| Smiles: | C(CC(Nc1nc(cs1)C1=Cc2cc(ccc2OC1=O)[Cl])=O)C(NCCc1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.1963 |
| logD: | 4.1853 |
| logSw: | -4.5946 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.126 |
| InChI Key: | ASICTWLJHDWCDV-UHFFFAOYSA-N |