3-(2-{[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,3-thiazol-4-yl)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(2-{[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,3-thiazol-4-yl)-2H-1-benzopyran-2-one
3-(2-{[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,3-thiazol-4-yl)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | M040-0426 |
| Compound Name: | 3-(2-{[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,3-thiazol-4-yl)-2H-1-benzopyran-2-one |
| Molecular Weight: | 466.31 |
| Molecular Formula: | C21 H12 Br N3 O3 S |
| Smiles: | C(c1nc(c2ccc(cc2)[Br])no1)c1nc(cs1)C1=Cc2ccccc2OC1=O |
| Stereo: | ACHIRAL |
| logP: | 5.7885 |
| logD: | 5.7885 |
| logSw: | -6.0629 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.461 |
| InChI Key: | WWMWAYLWRHTYFG-UHFFFAOYSA-N |