tert-butyl {[6-ethyl-3-(4-methyl-1,3-thiazol-2-yl)-4-oxo-4H-1-benzopyran-7-yl]oxy}acetate
Chemical Structure Depiction of
tert-butyl {[6-ethyl-3-(4-methyl-1,3-thiazol-2-yl)-4-oxo-4H-1-benzopyran-7-yl]oxy}acetate
tert-butyl {[6-ethyl-3-(4-methyl-1,3-thiazol-2-yl)-4-oxo-4H-1-benzopyran-7-yl]oxy}acetate
Compound characteristics
| Compound ID: | D715-0902 |
| Compound Name: | tert-butyl {[6-ethyl-3-(4-methyl-1,3-thiazol-2-yl)-4-oxo-4H-1-benzopyran-7-yl]oxy}acetate |
| Molecular Weight: | 401.48 |
| Molecular Formula: | C21 H23 N O5 S |
| Smiles: | CCc1cc2C(C(=COc2cc1OCC(=O)OC(C)(C)C)c1nc(C)cs1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3885 |
| logD: | 4.3885 |
| logSw: | -4.3639 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.526 |
| InChI Key: | DQWAXWNAGNQWTN-UHFFFAOYSA-N |