N-[(4-fluorophenyl)methyl]-3-[2-(4-methylbenzene-1-sulfonyl)ethyl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-3-[2-(4-methylbenzene-1-sulfonyl)ethyl]-1,2,4-oxadiazole-5-carboxamide
N-[(4-fluorophenyl)methyl]-3-[2-(4-methylbenzene-1-sulfonyl)ethyl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | M027-0456 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-3-[2-(4-methylbenzene-1-sulfonyl)ethyl]-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 403.43 |
| Molecular Formula: | C19 H18 F N3 O4 S |
| Smiles: | Cc1ccc(cc1)S(CCc1nc(C(NCc2ccc(cc2)F)=O)on1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5493 |
| logD: | 2.5492 |
| logSw: | -2.9096 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.356 |
| InChI Key: | BNIWYEDSSHERGN-UHFFFAOYSA-N |