{amino[2-cyano-3-(4-fluorophenyl)oxiran-2-yl]methylidene}propanedinitrile
Chemical Structure Depiction of
{amino[2-cyano-3-(4-fluorophenyl)oxiran-2-yl]methylidene}propanedinitrile
{amino[2-cyano-3-(4-fluorophenyl)oxiran-2-yl]methylidene}propanedinitrile
Compound characteristics
| Compound ID: | 8020-3585 |
| Compound Name: | {amino[2-cyano-3-(4-fluorophenyl)oxiran-2-yl]methylidene}propanedinitrile |
| Molecular Weight: | 254.22 |
| Molecular Formula: | C13 H7 F N4 O |
| Smiles: | C(C(C#N)=C(C1(C#N)C(c2ccc(cc2)F)O1)N)#N |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.1877 |
| logD: | 1.1806 |
| logSw: | -1.65 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.493 |
| InChI Key: | FBMSASBUAQECSA-UHFFFAOYSA-N |