5-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-(4-ethylphenyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Chemical Structure Depiction of
5-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-(4-ethylphenyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
5-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-(4-ethylphenyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | L984-0301 |
| Compound Name: | 5-{[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-(4-ethylphenyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one |
| Molecular Weight: | 432.87 |
| Molecular Formula: | C22 H17 Cl N6 O2 |
| Smiles: | CCc1ccc(cc1)n1c2c(cn1)C(N(Cc1nc(c3ccc(cc3)[Cl])no1)C=N2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1461 |
| logD: | 5.1461 |
| logSw: | -5.5025 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 71.632 |
| InChI Key: | VQHPPQAWVVYYPI-UHFFFAOYSA-N |