N-[2-(1H-imidazol-4-yl)ethyl]-2-{[3-(2-methyl-1,3-thiazol-4-yl)-2-oxo-2H-1-benzopyran-7-yl]oxy}acetamide
Chemical Structure Depiction of
N-[2-(1H-imidazol-4-yl)ethyl]-2-{[3-(2-methyl-1,3-thiazol-4-yl)-2-oxo-2H-1-benzopyran-7-yl]oxy}acetamide
N-[2-(1H-imidazol-4-yl)ethyl]-2-{[3-(2-methyl-1,3-thiazol-4-yl)-2-oxo-2H-1-benzopyran-7-yl]oxy}acetamide
Compound characteristics
| Compound ID: | Y043-8534 |
| Compound Name: | N-[2-(1H-imidazol-4-yl)ethyl]-2-{[3-(2-methyl-1,3-thiazol-4-yl)-2-oxo-2H-1-benzopyran-7-yl]oxy}acetamide |
| Molecular Weight: | 410.45 |
| Molecular Formula: | C20 H18 N4 O4 S |
| Smiles: | Cc1nc(cs1)C1=Cc2ccc(cc2OC1=O)OCC(NCCc1c[nH]cn1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.441 |
| logD: | 1.3432 |
| logSw: | -2.4181 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.035 |
| InChI Key: | LEJLQNWBKIENSJ-UHFFFAOYSA-N |