1-(3-bromophenyl)-4-[(3-chloro-4,5-diethoxyphenyl)methylidene]pyrazolidine-3,5-dione
Chemical Structure Depiction of
1-(3-bromophenyl)-4-[(3-chloro-4,5-diethoxyphenyl)methylidene]pyrazolidine-3,5-dione
1-(3-bromophenyl)-4-[(3-chloro-4,5-diethoxyphenyl)methylidene]pyrazolidine-3,5-dione
Compound characteristics
Compound ID: | 4285-2214 |
Compound Name: | 1-(3-bromophenyl)-4-[(3-chloro-4,5-diethoxyphenyl)methylidene]pyrazolidine-3,5-dione |
Molecular Weight: | 465.73 |
Molecular Formula: | C20 H18 Br Cl N2 O4 |
Smiles: | CCOc1cc(/C=C2/C(NN(C2=O)c2cccc(c2)[Br])=O)cc(c1OCC)[Cl] |
Stereo: | ACHIRAL |
logP: | 4.6462 |
logD: | 4.2978 |
logSw: | -4.88 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 57.267 |
InChI Key: | KAQZSSSXUHLUDS-UHFFFAOYSA-N |