1-(3-bromophenyl)-3-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]pyridazin-4(1H)-one
Chemical Structure Depiction of
1-(3-bromophenyl)-3-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]pyridazin-4(1H)-one
1-(3-bromophenyl)-3-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]pyridazin-4(1H)-one
Compound characteristics
| Compound ID: | M115-1597 |
| Compound Name: | 1-(3-bromophenyl)-3-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]pyridazin-4(1H)-one |
| Molecular Weight: | 485.29 |
| Molecular Formula: | C21 H17 Br N4 O5 |
| Smiles: | COc1cc(cc(c1OC)OC)c1nc(C2C(C=CN(c3cccc(c3)[Br])N=2)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.051 |
| logD: | 4.051 |
| logSw: | -4.2421 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 81.033 |
| InChI Key: | UFMKLDQMCCGGOR-UHFFFAOYSA-N |