[1-(4-chlorophenyl)-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl]acetonitrile
Chemical Structure Depiction of
[1-(4-chlorophenyl)-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl]acetonitrile
[1-(4-chlorophenyl)-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl]acetonitrile
Compound characteristics
| Compound ID: | C801-0339 |
| Compound Name: | [1-(4-chlorophenyl)-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl]acetonitrile |
| Molecular Weight: | 285.69 |
| Molecular Formula: | C13 H8 Cl N5 O |
| Smiles: | C(C#N)N1C=Nc2c(cnn2c2ccc(cc2)[Cl])C1=O |
| Stereo: | ACHIRAL |
| logP: | 1.7858 |
| logD: | 1.7858 |
| logSw: | -2.9009 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 58.031 |
| InChI Key: | FNEUZBVQOGJLSS-UHFFFAOYSA-N |