3-[1-(4-bromophenyl)-3-methyl-1H-pyrazol-4-yl]-N-(2-phenylethyl)-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
3-[1-(4-bromophenyl)-3-methyl-1H-pyrazol-4-yl]-N-(2-phenylethyl)-1,2,4-oxadiazole-5-carboxamide
3-[1-(4-bromophenyl)-3-methyl-1H-pyrazol-4-yl]-N-(2-phenylethyl)-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | F386-0897 |
| Compound Name: | 3-[1-(4-bromophenyl)-3-methyl-1H-pyrazol-4-yl]-N-(2-phenylethyl)-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 452.31 |
| Molecular Formula: | C21 H18 Br N5 O2 |
| Smiles: | Cc1c(cn(c2ccc(cc2)[Br])n1)c1nc(C(NCCc2ccccc2)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.9951 |
| logD: | 3.9951 |
| logSw: | -4.2909 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.881 |
| InChI Key: | ITKUHTXUUYWVOR-UHFFFAOYSA-N |