[2-chloro-2,2-difluoro-1-(4-methoxyanilino)ethylidene]propanedinitrile
Chemical Structure Depiction of
[2-chloro-2,2-difluoro-1-(4-methoxyanilino)ethylidene]propanedinitrile
[2-chloro-2,2-difluoro-1-(4-methoxyanilino)ethylidene]propanedinitrile
Compound characteristics
Compound ID: | 8012-6398 |
Compound Name: | [2-chloro-2,2-difluoro-1-(4-methoxyanilino)ethylidene]propanedinitrile |
Molecular Weight: | 283.66 |
Molecular Formula: | C12 H8 Cl F2 N3 O |
Smiles: | COc1ccc(cc1)NC(=C(C#N)C#N)C(F)(F)[Cl] |
Stereo: | ACHIRAL |
logP: | 3.0255 |
logD: | -1.1187 |
logSw: | -3.7054 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 52.305 |
InChI Key: | VTNNKBISQAJCFJ-UHFFFAOYSA-N |