N-(4-acetylphenyl)-3-{3-[(4-methylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}propanamide
Chemical Structure Depiction of
N-(4-acetylphenyl)-3-{3-[(4-methylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}propanamide
N-(4-acetylphenyl)-3-{3-[(4-methylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}propanamide
Compound characteristics
| Compound ID: | G729-0904 |
| Compound Name: | N-(4-acetylphenyl)-3-{3-[(4-methylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}propanamide |
| Molecular Weight: | 427.48 |
| Molecular Formula: | C21 H21 N3 O5 S |
| Smiles: | CC(c1ccc(cc1)NC(CCc1nc(CS(c2ccc(C)cc2)(=O)=O)no1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3491 |
| logD: | 2.3487 |
| logSw: | -2.7895 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.313 |
| InChI Key: | BECHMGQSWJPQAX-UHFFFAOYSA-N |