7-{2-[2-(5-{[(4-fluorophenyl)methoxy]methyl}-1,2,4-oxadiazol-3-yl)piperidin-1-yl]-2-oxoethyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-{2-[2-(5-{[(4-fluorophenyl)methoxy]methyl}-1,2,4-oxadiazol-3-yl)piperidin-1-yl]-2-oxoethyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
7-{2-[2-(5-{[(4-fluorophenyl)methoxy]methyl}-1,2,4-oxadiazol-3-yl)piperidin-1-yl]-2-oxoethyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | S595-1456 |
| Compound Name: | 7-{2-[2-(5-{[(4-fluorophenyl)methoxy]methyl}-1,2,4-oxadiazol-3-yl)piperidin-1-yl]-2-oxoethyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 511.51 |
| Molecular Formula: | C24 H26 F N7 O5 |
| Smiles: | CN1C(c2c(ncn2CC(N2CCCCC2c2nc(COCc3ccc(cc3)F)on2)=O)N(C)C1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.553 |
| logD: | 1.553 |
| logSw: | -2.0141 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 98.553 |
| InChI Key: | ZUSDWWQIOWNAAY-KRWDZBQOSA-N |