4-(4-methoxyphenyl)-2-({3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)phthalazin-1(2H)-one
Chemical Structure Depiction of
4-(4-methoxyphenyl)-2-({3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)phthalazin-1(2H)-one
4-(4-methoxyphenyl)-2-({3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)phthalazin-1(2H)-one
Compound characteristics
| Compound ID: | L100-0327 |
| Compound Name: | 4-(4-methoxyphenyl)-2-({3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)phthalazin-1(2H)-one |
| Molecular Weight: | 456.52 |
| Molecular Formula: | C25 H20 N4 O3 S |
| Smiles: | COc1ccc(cc1)C1c2ccccc2C(N(Cc2nc(c3ccc(cc3)SC)no2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1275 |
| logD: | 5.1275 |
| logSw: | -4.9426 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 66.082 |
| InChI Key: | BVEBPZJUVVHBSC-UHFFFAOYSA-N |