6-hexyl-2-oxo-3-(4-phenyl-1,3-thiazol-2-yl)-2H-1-benzopyran-7-yl acetate
Chemical Structure Depiction of
6-hexyl-2-oxo-3-(4-phenyl-1,3-thiazol-2-yl)-2H-1-benzopyran-7-yl acetate
6-hexyl-2-oxo-3-(4-phenyl-1,3-thiazol-2-yl)-2H-1-benzopyran-7-yl acetate
Compound characteristics
| Compound ID: | 1416-0467 |
| Compound Name: | 6-hexyl-2-oxo-3-(4-phenyl-1,3-thiazol-2-yl)-2H-1-benzopyran-7-yl acetate |
| Molecular Weight: | 447.55 |
| Molecular Formula: | C26 H25 N O4 S |
| Smiles: | CCCCCCc1cc2C=C(C(=O)Oc2cc1OC(C)=O)c1nc(cs1)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 7.2634 |
| logD: | 7.2634 |
| logSw: | -5.5628 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.46 |
| InChI Key: | KZPVCPTVMAIORF-UHFFFAOYSA-N |