2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-3-(ethylamino)-3-(methylsulfanyl)prop-2-enenitrile
Chemical Structure Depiction of
2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-3-(ethylamino)-3-(methylsulfanyl)prop-2-enenitrile
2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-3-(ethylamino)-3-(methylsulfanyl)prop-2-enenitrile
Compound characteristics
| Compound ID: | C201-1246 |
| Compound Name: | 2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-3-(ethylamino)-3-(methylsulfanyl)prop-2-enenitrile |
| Molecular Weight: | 320.8 |
| Molecular Formula: | C14 H13 Cl N4 O S |
| Smiles: | CCN/C(=C(/C#N)c1nc(c2ccc(cc2)[Cl])no1)SC |
| Stereo: | ACHIRAL |
| logP: | 3.936 |
| logD: | 3.9359 |
| logSw: | -4.5286 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.883 |
| InChI Key: | MNKPTKCEQCRQRO-UHFFFAOYSA-N |