6-[5-(3,5-dimethylphenyl)-1,2,4-oxadiazol-3-yl]-3-methyl-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
6-[5-(3,5-dimethylphenyl)-1,2,4-oxadiazol-3-yl]-3-methyl-1,3-benzoxazol-2(3H)-one
6-[5-(3,5-dimethylphenyl)-1,2,4-oxadiazol-3-yl]-3-methyl-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | M355-0085 |
| Compound Name: | 6-[5-(3,5-dimethylphenyl)-1,2,4-oxadiazol-3-yl]-3-methyl-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 321.33 |
| Molecular Formula: | C18 H15 N3 O3 |
| Smiles: | Cc1cc(C)cc(c1)c1nc(c2ccc3c(c2)OC(N3C)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.2088 |
| logD: | 4.2088 |
| logSw: | -4.4606 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 54.51 |
| InChI Key: | PKWUMRJOTXOVIU-UHFFFAOYSA-N |