3-[2-(4-methylbenzene-1-sulfonyl)ethyl]-N-[(4-methylphenyl)methyl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
3-[2-(4-methylbenzene-1-sulfonyl)ethyl]-N-[(4-methylphenyl)methyl]-1,2,4-oxadiazole-5-carboxamide
3-[2-(4-methylbenzene-1-sulfonyl)ethyl]-N-[(4-methylphenyl)methyl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | M027-0386 |
| Compound Name: | 3-[2-(4-methylbenzene-1-sulfonyl)ethyl]-N-[(4-methylphenyl)methyl]-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 399.47 |
| Molecular Formula: | C20 H21 N3 O4 S |
| Smiles: | Cc1ccc(CNC(c2nc(CCS(c3ccc(C)cc3)(=O)=O)no2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.9436 |
| logD: | 2.9435 |
| logSw: | -3.5088 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.356 |
| InChI Key: | CENZLMONROMGKF-UHFFFAOYSA-N |