N-(3,4-dimethoxyphenyl)-3-{3-[(4-methylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}propanamide
Chemical Structure Depiction of
N-(3,4-dimethoxyphenyl)-3-{3-[(4-methylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}propanamide
N-(3,4-dimethoxyphenyl)-3-{3-[(4-methylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}propanamide
Compound characteristics
| Compound ID: | G729-0924 |
| Compound Name: | N-(3,4-dimethoxyphenyl)-3-{3-[(4-methylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}propanamide |
| Molecular Weight: | 445.49 |
| Molecular Formula: | C21 H23 N3 O6 S |
| Smiles: | Cc1ccc(cc1)S(Cc1nc(CCC(Nc2ccc(c(c2)OC)OC)=O)on1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3419 |
| logD: | 2.3419 |
| logSw: | -2.9857 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 99.747 |
| InChI Key: | DUIOOSAUESSIQV-UHFFFAOYSA-N |