ethyl 4-[1-(4-chlorophenyl)-6-methyl-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl]benzoate
Chemical Structure Depiction of
ethyl 4-[1-(4-chlorophenyl)-6-methyl-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl]benzoate
ethyl 4-[1-(4-chlorophenyl)-6-methyl-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl]benzoate
Compound characteristics
| Compound ID: | C374-1609 |
| Compound Name: | ethyl 4-[1-(4-chlorophenyl)-6-methyl-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl]benzoate |
| Molecular Weight: | 408.84 |
| Molecular Formula: | C21 H17 Cl N4 O3 |
| Smiles: | CCOC(c1ccc(cc1)N1C(C)=Nc2c(cnn2c2ccc(cc2)[Cl])C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3607 |
| logD: | 4.3542 |
| logSw: | -4.5059 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.478 |
| InChI Key: | RTNDKLOBRISSRU-UHFFFAOYSA-N |