3-(3-chloro-4-fluoroanilino)-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(3-chloro-4-fluoroanilino)-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione
3-(3-chloro-4-fluoroanilino)-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione
Compound characteristics
Compound ID: | E470-0160 |
Compound Name: | 3-(3-chloro-4-fluoroanilino)-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione |
Molecular Weight: | 315.73 |
Molecular Formula: | C17 H11 Cl F N O2 |
Smiles: | Cc1ccc(cc1)C1=C(C(C1=O)=O)Nc1ccc(c(c1)[Cl])F |
Stereo: | ACHIRAL |
logP: | 4.3364 |
logD: | 3.7171 |
logSw: | -4.4835 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 35.894 |
InChI Key: | ZQGUTKZBTICPSJ-UHFFFAOYSA-N |