N~1~-[4-(8-methoxy-2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]-N~4~-(4-methylcyclohexyl)butanediamide
Chemical Structure Depiction of
N~1~-[4-(8-methoxy-2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]-N~4~-(4-methylcyclohexyl)butanediamide
N~1~-[4-(8-methoxy-2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]-N~4~-(4-methylcyclohexyl)butanediamide
Compound characteristics
| Compound ID: | K232-1780 |
| Compound Name: | N~1~-[4-(8-methoxy-2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]-N~4~-(4-methylcyclohexyl)butanediamide |
| Molecular Weight: | 469.56 |
| Molecular Formula: | C24 H27 N3 O5 S |
| Smiles: | CC1CCC(CC1)NC(CCC(Nc1nc(cs1)C1=Cc2cccc(c2OC1=O)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0744 |
| logD: | 4.0634 |
| logSw: | -4.3355 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.324 |
| InChI Key: | SHYIDUDNJQBPKG-UHFFFAOYSA-N |