3-{3-[(4-methylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-(3,4,5-trimethoxyphenyl)propanamide
Chemical Structure Depiction of
3-{3-[(4-methylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-(3,4,5-trimethoxyphenyl)propanamide
3-{3-[(4-methylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-(3,4,5-trimethoxyphenyl)propanamide
Compound characteristics
| Compound ID: | G729-0982 |
| Compound Name: | 3-{3-[(4-methylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-(3,4,5-trimethoxyphenyl)propanamide |
| Molecular Weight: | 475.52 |
| Molecular Formula: | C22 H25 N3 O7 S |
| Smiles: | Cc1ccc(cc1)S(Cc1nc(CCC(Nc2cc(c(c(c2)OC)OC)OC)=O)on1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1876 |
| logD: | 2.187 |
| logSw: | -2.9601 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 107.464 |
| InChI Key: | NQUWNDNDXDIYTJ-UHFFFAOYSA-N |