4-(3-{[5-(4-methoxyphenyl)-1,2,4-oxadiazol-3-yl]methyl}pyrrolidine-1-carbonyl)phthalazin-1(2H)-one
Chemical Structure Depiction of
4-(3-{[5-(4-methoxyphenyl)-1,2,4-oxadiazol-3-yl]methyl}pyrrolidine-1-carbonyl)phthalazin-1(2H)-one
4-(3-{[5-(4-methoxyphenyl)-1,2,4-oxadiazol-3-yl]methyl}pyrrolidine-1-carbonyl)phthalazin-1(2H)-one
Compound characteristics
| Compound ID: | S248-3098 |
| Compound Name: | 4-(3-{[5-(4-methoxyphenyl)-1,2,4-oxadiazol-3-yl]methyl}pyrrolidine-1-carbonyl)phthalazin-1(2H)-one |
| Molecular Weight: | 431.45 |
| Molecular Formula: | C23 H21 N5 O4 |
| Smiles: | COc1ccc(cc1)c1nc(CC2CCN(C2)C(C2c3ccccc3C(NN=2)=O)=O)no1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8454 |
| logD: | 2.4572 |
| logSw: | -3.5177 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.517 |
| InChI Key: | PPOIMQCVVAFLDA-AWEZNQCLSA-N |