6-chloro-3-(2-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,3-thiazol-4-yl)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-chloro-3-(2-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,3-thiazol-4-yl)-2H-1-benzopyran-2-one
6-chloro-3-(2-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,3-thiazol-4-yl)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | M040-1167 |
| Compound Name: | 6-chloro-3-(2-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,3-thiazol-4-yl)-2H-1-benzopyran-2-one |
| Molecular Weight: | 481.91 |
| Molecular Formula: | C23 H16 Cl N3 O5 S |
| Smiles: | COc1ccc(cc1OC)c1nc(Cc2nc(cs2)C2=Cc3cc(ccc3OC2=O)[Cl])on1 |
| Stereo: | ACHIRAL |
| logP: | 5.1889 |
| logD: | 5.1889 |
| logSw: | -5.7189 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 77.722 |
| InChI Key: | RUTWFUSYMIPVSH-UHFFFAOYSA-N |