2-{[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl}-6-(3,4-dimethoxyphenyl)pyridazin-3(2H)-one
Chemical Structure Depiction of
2-{[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl}-6-(3,4-dimethoxyphenyl)pyridazin-3(2H)-one
2-{[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl}-6-(3,4-dimethoxyphenyl)pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | F839-0416 |
| Compound Name: | 2-{[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl}-6-(3,4-dimethoxyphenyl)pyridazin-3(2H)-one |
| Molecular Weight: | 469.29 |
| Molecular Formula: | C21 H17 Br N4 O4 |
| Smiles: | COc1ccc(cc1OC)C1C=CC(N(Cc2nc(c3cccc(c3)[Br])no2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3124 |
| logD: | 4.3124 |
| logSw: | -4.6003 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 75.151 |
| InChI Key: | GGAPOOGAFJXKQM-UHFFFAOYSA-N |