6-[5-(3,4-diethoxyphenyl)-1,2,4-oxadiazol-3-yl]-3-(propan-2-yl)-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
6-[5-(3,4-diethoxyphenyl)-1,2,4-oxadiazol-3-yl]-3-(propan-2-yl)-1,3-benzoxazol-2(3H)-one
6-[5-(3,4-diethoxyphenyl)-1,2,4-oxadiazol-3-yl]-3-(propan-2-yl)-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | M355-0849 |
| Compound Name: | 6-[5-(3,4-diethoxyphenyl)-1,2,4-oxadiazol-3-yl]-3-(propan-2-yl)-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 409.44 |
| Molecular Formula: | C22 H23 N3 O5 |
| Smiles: | CCOc1ccc(cc1OCC)c1nc(c2ccc3c(c2)OC(N3C(C)C)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.4975 |
| logD: | 4.4975 |
| logSw: | -4.4667 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 68.885 |
| InChI Key: | UQLGWKGHDULWRF-UHFFFAOYSA-N |