4-[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]-2-[3-(methylsulfanyl)phenyl]phthalazin-1(2H)-one
Chemical Structure Depiction of
4-[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]-2-[3-(methylsulfanyl)phenyl]phthalazin-1(2H)-one
4-[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]-2-[3-(methylsulfanyl)phenyl]phthalazin-1(2H)-one
Compound characteristics
| Compound ID: | F990-0478 |
| Compound Name: | 4-[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]-2-[3-(methylsulfanyl)phenyl]phthalazin-1(2H)-one |
| Molecular Weight: | 491.36 |
| Molecular Formula: | C23 H15 Br N4 O2 S |
| Smiles: | CSc1cccc(c1)N1C(c2ccccc2C(c2nc(c3cccc(c3)[Br])no2)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9535 |
| logD: | 5.9507 |
| logSw: | -5.612 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.453 |
| InChI Key: | IVIUGPWPNAPIJN-UHFFFAOYSA-N |