N-{[4-(dimethylamino)phenyl]methyl}-3-[2-(4-methylbenzene-1-sulfonyl)ethyl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
N-{[4-(dimethylamino)phenyl]methyl}-3-[2-(4-methylbenzene-1-sulfonyl)ethyl]-1,2,4-oxadiazole-5-carboxamide
N-{[4-(dimethylamino)phenyl]methyl}-3-[2-(4-methylbenzene-1-sulfonyl)ethyl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | M027-0583 |
| Compound Name: | N-{[4-(dimethylamino)phenyl]methyl}-3-[2-(4-methylbenzene-1-sulfonyl)ethyl]-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 428.51 |
| Molecular Formula: | C21 H24 N4 O4 S |
| Smiles: | Cc1ccc(cc1)S(CCc1nc(C(NCc2ccc(cc2)N(C)C)=O)on1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6102 |
| logD: | 2.5948 |
| logSw: | -3.1426 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.161 |
| InChI Key: | RTMSHJONSAROHX-UHFFFAOYSA-N |