3-(2-methyl-1,3-thiazol-4-yl)-2-oxo-2H-1-benzopyran-7-yl thiophene-2-carboxylate
Chemical Structure Depiction of
3-(2-methyl-1,3-thiazol-4-yl)-2-oxo-2H-1-benzopyran-7-yl thiophene-2-carboxylate
3-(2-methyl-1,3-thiazol-4-yl)-2-oxo-2H-1-benzopyran-7-yl thiophene-2-carboxylate
Compound characteristics
| Compound ID: | Y042-3236 |
| Compound Name: | 3-(2-methyl-1,3-thiazol-4-yl)-2-oxo-2H-1-benzopyran-7-yl thiophene-2-carboxylate |
| Molecular Weight: | 369.42 |
| Molecular Formula: | C18 H11 N O4 S2 |
| Smiles: | Cc1nc(cs1)C1=Cc2ccc(cc2OC1=O)OC(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.932 |
| logD: | 3.932 |
| logSw: | -4.1654 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.097 |
| InChI Key: | XPOOSKFJNHDSCC-UHFFFAOYSA-N |