4-(2-{3-[2-(3-methylphenoxy)ethyl]-1,2,4-oxadiazol-5-yl}pyrrolidine-1-carbonyl)phthalazin-1(2H)-one
Chemical Structure Depiction of
4-(2-{3-[2-(3-methylphenoxy)ethyl]-1,2,4-oxadiazol-5-yl}pyrrolidine-1-carbonyl)phthalazin-1(2H)-one
4-(2-{3-[2-(3-methylphenoxy)ethyl]-1,2,4-oxadiazol-5-yl}pyrrolidine-1-carbonyl)phthalazin-1(2H)-one
Compound characteristics
| Compound ID: | S613-0558 |
| Compound Name: | 4-(2-{3-[2-(3-methylphenoxy)ethyl]-1,2,4-oxadiazol-5-yl}pyrrolidine-1-carbonyl)phthalazin-1(2H)-one |
| Molecular Weight: | 445.48 |
| Molecular Formula: | C24 H23 N5 O4 |
| Smiles: | Cc1cccc(c1)OCCc1nc(C2CCCN2C(C2c3ccccc3C(NN=2)=O)=O)on1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2594 |
| logD: | 3.0044 |
| logSw: | -3.5589 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.152 |
| InChI Key: | CNIXQRILOIFEAK-IBGZPJMESA-N |