3-{3-[(4-chlorobenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-(2,5-dimethoxyphenyl)propanamide
Chemical Structure Depiction of
3-{3-[(4-chlorobenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-(2,5-dimethoxyphenyl)propanamide
3-{3-[(4-chlorobenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-(2,5-dimethoxyphenyl)propanamide
Compound characteristics
| Compound ID: | G729-0410 |
| Compound Name: | 3-{3-[(4-chlorobenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-(2,5-dimethoxyphenyl)propanamide |
| Molecular Weight: | 465.91 |
| Molecular Formula: | C20 H20 Cl N3 O6 S |
| Smiles: | COc1ccc(c(c1)NC(CCc1nc(CS(c2ccc(cc2)[Cl])(=O)=O)no1)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.6618 |
| logD: | 2.6609 |
| logSw: | -3.5938 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.962 |
| InChI Key: | GKQVKXRMKJMCPI-UHFFFAOYSA-N |