4-(3-{[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]methyl}pyrrolidine-1-carbonyl)phthalazin-1(2H)-one
Chemical Structure Depiction of
4-(3-{[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]methyl}pyrrolidine-1-carbonyl)phthalazin-1(2H)-one
4-(3-{[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]methyl}pyrrolidine-1-carbonyl)phthalazin-1(2H)-one
Compound characteristics
| Compound ID: | S248-3875 |
| Compound Name: | 4-(3-{[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]methyl}pyrrolidine-1-carbonyl)phthalazin-1(2H)-one |
| Molecular Weight: | 409.44 |
| Molecular Formula: | C21 H23 N5 O4 |
| Smiles: | C1CN(CC1Cc1nc(C2CCOCC2)on1)C(C1c2ccccc2C(NN=1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0655 |
| logD: | 1.6773 |
| logSw: | -2.8989 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.074 |
| InChI Key: | JPEZEJSYPBPGOO-ZDUSSCGKSA-N |