2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-3-(methylsulfanyl)-3-[(prop-2-en-1-yl)amino]prop-2-enenitrile
Chemical Structure Depiction of
2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-3-(methylsulfanyl)-3-[(prop-2-en-1-yl)amino]prop-2-enenitrile
2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-3-(methylsulfanyl)-3-[(prop-2-en-1-yl)amino]prop-2-enenitrile
Compound characteristics
| Compound ID: | C201-1245 |
| Compound Name: | 2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-3-(methylsulfanyl)-3-[(prop-2-en-1-yl)amino]prop-2-enenitrile |
| Molecular Weight: | 332.81 |
| Molecular Formula: | C15 H13 Cl N4 O S |
| Smiles: | CSC(=C(/C#N)c1nc(c2ccc(cc2)[Cl])no1)\NCC=C |
| Stereo: | ACHIRAL |
| logP: | 4.0796 |
| logD: | 4.0796 |
| logSw: | -4.5364 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.099 |
| InChI Key: | WKHSKKZKJDMBGI-UHFFFAOYSA-N |