4-({3-chloro-5-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-1-(4-fluorophenyl)pyrazolidine-3,5-dione
Chemical Structure Depiction of
4-({3-chloro-5-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-1-(4-fluorophenyl)pyrazolidine-3,5-dione
4-({3-chloro-5-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-1-(4-fluorophenyl)pyrazolidine-3,5-dione
Compound characteristics
Compound ID: | 4169-2442 |
Compound Name: | 4-({3-chloro-5-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-1-(4-fluorophenyl)pyrazolidine-3,5-dione |
Molecular Weight: | 402.81 |
Molecular Formula: | C20 H16 Cl F N2 O4 |
Smiles: | COc1cc(/C=C2/C(NN(C2=O)c2ccc(cc2)F)=O)cc(c1OCC=C)[Cl] |
Stereo: | ACHIRAL |
logP: | 3.7491 |
logD: | 3.3776 |
logSw: | -4.2166 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 57.981 |
InChI Key: | NYVHDKHTZJTZHU-UHFFFAOYSA-N |