6-bromo-3-(2-{[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,3-thiazol-4-yl)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-bromo-3-(2-{[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,3-thiazol-4-yl)-2H-1-benzopyran-2-one
6-bromo-3-(2-{[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,3-thiazol-4-yl)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | M040-1082 |
| Compound Name: | 6-bromo-3-(2-{[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,3-thiazol-4-yl)-2H-1-benzopyran-2-one |
| Molecular Weight: | 496.34 |
| Molecular Formula: | C22 H14 Br N3 O4 S |
| Smiles: | COc1ccccc1c1nc(Cc2nc(cs2)C2=Cc3cc(ccc3OC2=O)[Br])on1 |
| Stereo: | ACHIRAL |
| logP: | 5.2276 |
| logD: | 5.2276 |
| logSw: | -5.1643 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 70.091 |
| InChI Key: | BHVYSCXQIJZSAP-UHFFFAOYSA-N |