1-(3-chloro-4-fluorophenyl)-4-[(4-hydroxy-3-methoxyphenyl)methylidene]pyrazolidine-3,5-dione
Chemical Structure Depiction of
1-(3-chloro-4-fluorophenyl)-4-[(4-hydroxy-3-methoxyphenyl)methylidene]pyrazolidine-3,5-dione
1-(3-chloro-4-fluorophenyl)-4-[(4-hydroxy-3-methoxyphenyl)methylidene]pyrazolidine-3,5-dione
Compound characteristics
Compound ID: | 8011-6341 |
Compound Name: | 1-(3-chloro-4-fluorophenyl)-4-[(4-hydroxy-3-methoxyphenyl)methylidene]pyrazolidine-3,5-dione |
Molecular Weight: | 362.74 |
Molecular Formula: | C17 H12 Cl F N2 O4 |
Smiles: | COc1cc(\C=C2/C(NN(C2=O)c2ccc(c(c2)[Cl])F)=O)ccc1O |
Stereo: | ACHIRAL |
logP: | 2.273 |
logD: | 1.2048 |
logSw: | -3.1395 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 66.938 |
InChI Key: | QIOVFDFEGJTFRP-UHFFFAOYSA-N |