3-(2-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,3-thiazol-4-yl)-6-methyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(2-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,3-thiazol-4-yl)-6-methyl-2H-1-benzopyran-2-one
3-(2-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,3-thiazol-4-yl)-6-methyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | M040-1140 |
| Compound Name: | 3-(2-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,3-thiazol-4-yl)-6-methyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 461.5 |
| Molecular Formula: | C24 H19 N3 O5 S |
| Smiles: | Cc1ccc2c(C=C(C(=O)O2)c2csc(Cc3nc(c4ccc(c(c4)OC)OC)no3)n2)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.9324 |
| logD: | 4.9324 |
| logSw: | -4.8359 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 77.722 |
| InChI Key: | OJUFVGUKBPQICV-UHFFFAOYSA-N |