5-{3-[(4-methylbenzene-1-sulfonyl)methyl]phenyl}-3-[3-(1-methyl-1H-pyrazol-5-yl)phenyl]-1,2,4-oxadiazole
Chemical Structure Depiction of
5-{3-[(4-methylbenzene-1-sulfonyl)methyl]phenyl}-3-[3-(1-methyl-1H-pyrazol-5-yl)phenyl]-1,2,4-oxadiazole
5-{3-[(4-methylbenzene-1-sulfonyl)methyl]phenyl}-3-[3-(1-methyl-1H-pyrazol-5-yl)phenyl]-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | M321-0298 |
| Compound Name: | 5-{3-[(4-methylbenzene-1-sulfonyl)methyl]phenyl}-3-[3-(1-methyl-1H-pyrazol-5-yl)phenyl]-1,2,4-oxadiazole |
| Molecular Weight: | 470.55 |
| Molecular Formula: | C26 H22 N4 O3 S |
| Smiles: | Cc1ccc(cc1)S(Cc1cccc(c1)c1nc(c2cccc(c2)c2ccnn2C)no1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0831 |
| logD: | 5.0831 |
| logSw: | -5.0324 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 73.788 |
| InChI Key: | VDMWCGGHJHIPAT-UHFFFAOYSA-N |