3-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-8-methoxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-8-methoxy-2H-1-benzopyran-2-one
3-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-8-methoxy-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 2700-4395 |
| Compound Name: | 3-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-8-methoxy-2H-1-benzopyran-2-one |
| Molecular Weight: | 363.43 |
| Molecular Formula: | C21 H17 N O3 S |
| Smiles: | Cc1ccc(c(C)c1)c1csc(C2=Cc3cccc(c3OC2=O)OC)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.3709 |
| logD: | 5.3709 |
| logSw: | -5.4176 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.937 |
| InChI Key: | KGPHPTWHIVTGQN-UHFFFAOYSA-N |