N~1~-[(furan-2-yl)methyl]-N~4~-[4-(7-methoxy-2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]butanediamide
Chemical Structure Depiction of
N~1~-[(furan-2-yl)methyl]-N~4~-[4-(7-methoxy-2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]butanediamide
N~1~-[(furan-2-yl)methyl]-N~4~-[4-(7-methoxy-2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]butanediamide
Compound characteristics
| Compound ID: | K232-1917 |
| Compound Name: | N~1~-[(furan-2-yl)methyl]-N~4~-[4-(7-methoxy-2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]butanediamide |
| Molecular Weight: | 453.47 |
| Molecular Formula: | C22 H19 N3 O6 S |
| Smiles: | COc1ccc2C=C(C(=O)Oc2c1)c1csc(NC(CCC(NCc2ccco2)=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.8274 |
| logD: | 2.8164 |
| logSw: | -3.6133 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.577 |
| InChI Key: | NCUODMQLBGVQSD-UHFFFAOYSA-N |