2-(4-bromophenyl)-5-methyl-4-[(3,4,5-trimethoxyphenyl)methylidene]-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
2-(4-bromophenyl)-5-methyl-4-[(3,4,5-trimethoxyphenyl)methylidene]-2,4-dihydro-3H-pyrazol-3-one
2-(4-bromophenyl)-5-methyl-4-[(3,4,5-trimethoxyphenyl)methylidene]-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 2083-1654 |
| Compound Name: | 2-(4-bromophenyl)-5-methyl-4-[(3,4,5-trimethoxyphenyl)methylidene]-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 431.28 |
| Molecular Formula: | C20 H19 Br N2 O4 |
| Smiles: | CC1/C(=C\c2cc(c(c(c2)OC)OC)OC)C(N(c2ccc(cc2)[Br])N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1702 |
| logD: | 4.1702 |
| logSw: | -4.4213 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.565 |
| InChI Key: | DJJORHKATGMRML-UHFFFAOYSA-N |