3-[4-(4-ethylphenyl)-5-methyl-1,3-thiazol-2-yl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[4-(4-ethylphenyl)-5-methyl-1,3-thiazol-2-yl]-2H-1-benzopyran-2-one
3-[4-(4-ethylphenyl)-5-methyl-1,3-thiazol-2-yl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | K277-0126 |
| Compound Name: | 3-[4-(4-ethylphenyl)-5-methyl-1,3-thiazol-2-yl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 347.43 |
| Molecular Formula: | C21 H17 N O2 S |
| Smiles: | CCc1ccc(cc1)c1c(C)sc(C2=Cc3ccccc3OC2=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.7023 |
| logD: | 5.7023 |
| logSw: | -5.5734 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 31.3929 |
| InChI Key: | YPLWMHLKEWDQCG-UHFFFAOYSA-N |