5-{[4-(2H-1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]methyl}-3-(4-bromophenyl)-1,2,4-oxadiazole
Chemical Structure Depiction of
5-{[4-(2H-1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]methyl}-3-(4-bromophenyl)-1,2,4-oxadiazole
5-{[4-(2H-1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]methyl}-3-(4-bromophenyl)-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | M040-0428 |
| Compound Name: | 5-{[4-(2H-1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]methyl}-3-(4-bromophenyl)-1,2,4-oxadiazole |
| Molecular Weight: | 442.29 |
| Molecular Formula: | C19 H12 Br N3 O3 S |
| Smiles: | C(c1nc(c2ccc(cc2)[Br])no1)c1nc(cs1)c1ccc2c(c1)OCO2 |
| Stereo: | ACHIRAL |
| logP: | 6.1509 |
| logD: | 6.1509 |
| logSw: | -6.2258 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 58.654 |
| InChI Key: | UNEDFTVTTFKDOV-UHFFFAOYSA-N |