6-{5-[(3,4-dimethoxyphenyl)methyl]-1,2,4-oxadiazol-3-yl}-3-(propan-2-yl)-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
6-{5-[(3,4-dimethoxyphenyl)methyl]-1,2,4-oxadiazol-3-yl}-3-(propan-2-yl)-1,3-benzoxazol-2(3H)-one
6-{5-[(3,4-dimethoxyphenyl)methyl]-1,2,4-oxadiazol-3-yl}-3-(propan-2-yl)-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | M355-0796 |
| Compound Name: | 6-{5-[(3,4-dimethoxyphenyl)methyl]-1,2,4-oxadiazol-3-yl}-3-(propan-2-yl)-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 395.41 |
| Molecular Formula: | C21 H21 N3 O5 |
| Smiles: | CC(C)N1C(=O)Oc2cc(ccc12)c1nc(Cc2ccc(c(c2)OC)OC)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.0908 |
| logD: | 4.0908 |
| logSw: | -4.5434 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.392 |
| InChI Key: | QNKQZZMRRVLOSM-UHFFFAOYSA-N |