1-(3-bromophenyl)-4-[(4,5-dimethoxy-2-nitrophenyl)methylidene]pyrazolidine-3,5-dione
Chemical Structure Depiction of
1-(3-bromophenyl)-4-[(4,5-dimethoxy-2-nitrophenyl)methylidene]pyrazolidine-3,5-dione
1-(3-bromophenyl)-4-[(4,5-dimethoxy-2-nitrophenyl)methylidene]pyrazolidine-3,5-dione
Compound characteristics
| Compound ID: | 2083-1849 |
| Compound Name: | 1-(3-bromophenyl)-4-[(4,5-dimethoxy-2-nitrophenyl)methylidene]pyrazolidine-3,5-dione |
| Molecular Weight: | 448.23 |
| Molecular Formula: | C18 H14 Br N3 O6 |
| Smiles: | COc1cc(\C=C2/C(NN(C2=O)c2cccc(c2)[Br])=O)c(cc1OC)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.5497 |
| logD: | 2.0986 |
| logSw: | -2.9473 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.101 |
| InChI Key: | DJUOFPDRGIBWCS-UHFFFAOYSA-N |