3-(2-{[3-(3-fluoro-4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,3-thiazol-4-yl)-8-methoxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(2-{[3-(3-fluoro-4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,3-thiazol-4-yl)-8-methoxy-2H-1-benzopyran-2-one
3-(2-{[3-(3-fluoro-4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,3-thiazol-4-yl)-8-methoxy-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | M040-1122 |
| Compound Name: | 3-(2-{[3-(3-fluoro-4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,3-thiazol-4-yl)-8-methoxy-2H-1-benzopyran-2-one |
| Molecular Weight: | 465.46 |
| Molecular Formula: | C23 H16 F N3 O5 S |
| Smiles: | COc1ccc(cc1F)c1nc(Cc2nc(cs2)C2=Cc3cccc(c3OC2=O)OC)on1 |
| Stereo: | ACHIRAL |
| logP: | 5.0122 |
| logD: | 5.0122 |
| logSw: | -4.9362 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 77.406 |
| InChI Key: | QVRPEWZVPVZYNM-UHFFFAOYSA-N |