N~1~-(4-ethylphenyl)-N~4~-[4-(6-hexyl-7-hydroxy-2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]butanediamide
Chemical Structure Depiction of
N~1~-(4-ethylphenyl)-N~4~-[4-(6-hexyl-7-hydroxy-2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]butanediamide
N~1~-(4-ethylphenyl)-N~4~-[4-(6-hexyl-7-hydroxy-2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]butanediamide
Compound characteristics
| Compound ID: | K232-1877 |
| Compound Name: | N~1~-(4-ethylphenyl)-N~4~-[4-(6-hexyl-7-hydroxy-2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]butanediamide |
| Molecular Weight: | 547.67 |
| Molecular Formula: | C30 H33 N3 O5 S |
| Smiles: | CCCCCCc1cc2C=C(C(=O)Oc2cc1O)c1csc(NC(CCC(Nc2ccc(CC)cc2)=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.5052 |
| logD: | 6.4915 |
| logSw: | -5.3955 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 93.51 |
| InChI Key: | WNGAWOZIMIPGNO-UHFFFAOYSA-N |