ethyl (2-{[4-(4-methylphenyl)-1-oxo-1H-2-benzopyran-3-carbonyl]amino}-1,3-thiazol-4-yl)acetate
Chemical Structure Depiction of
ethyl (2-{[4-(4-methylphenyl)-1-oxo-1H-2-benzopyran-3-carbonyl]amino}-1,3-thiazol-4-yl)acetate
ethyl (2-{[4-(4-methylphenyl)-1-oxo-1H-2-benzopyran-3-carbonyl]amino}-1,3-thiazol-4-yl)acetate
Compound characteristics
| Compound ID: | C607-0711 |
| Compound Name: | ethyl (2-{[4-(4-methylphenyl)-1-oxo-1H-2-benzopyran-3-carbonyl]amino}-1,3-thiazol-4-yl)acetate |
| Molecular Weight: | 448.5 |
| Molecular Formula: | C24 H20 N2 O5 S |
| Smiles: | CCOC(Cc1csc(NC(C2=C(c3ccc(C)cc3)c3ccccc3C(=O)O2)=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.605 |
| logD: | 4.59 |
| logSw: | -4.523 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.759 |
| InChI Key: | XIPANRQFXFVMPY-UHFFFAOYSA-N |