4-[3-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)-1,2,4-oxadiazol-5-yl]benzonitrile
Chemical Structure Depiction of
4-[3-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)-1,2,4-oxadiazol-5-yl]benzonitrile
4-[3-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)-1,2,4-oxadiazol-5-yl]benzonitrile
Compound characteristics
| Compound ID: | M355-0074 |
| Compound Name: | 4-[3-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)-1,2,4-oxadiazol-5-yl]benzonitrile |
| Molecular Weight: | 318.29 |
| Molecular Formula: | C17 H10 N4 O3 |
| Smiles: | CN1C(=O)Oc2cc(ccc12)c1nc(c2ccc(C#N)cc2)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.2163 |
| logD: | 3.2163 |
| logSw: | -3.6455 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 71.566 |
| InChI Key: | RAXCBSJATBYBJY-UHFFFAOYSA-N |