ethyl 1-[3-amino-4-(3-chloro-4-fluorophenyl)-2-(4-methoxyphenyl)-2H-pyrazolo[3,4-d]pyrimidin-6-yl]piperidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-[3-amino-4-(3-chloro-4-fluorophenyl)-2-(4-methoxyphenyl)-2H-pyrazolo[3,4-d]pyrimidin-6-yl]piperidine-3-carboxylate
ethyl 1-[3-amino-4-(3-chloro-4-fluorophenyl)-2-(4-methoxyphenyl)-2H-pyrazolo[3,4-d]pyrimidin-6-yl]piperidine-3-carboxylate
Compound characteristics
| Compound ID: | V009-1877 |
| Compound Name: | ethyl 1-[3-amino-4-(3-chloro-4-fluorophenyl)-2-(4-methoxyphenyl)-2H-pyrazolo[3,4-d]pyrimidin-6-yl]piperidine-3-carboxylate |
| Molecular Weight: | 524.98 |
| Molecular Formula: | C26 H26 Cl F N6 O3 |
| Salt: | not_available |
| Smiles: | CCOC(C1CCCN(C1)c1nc(c2ccc(c(c2)[Cl])F)c2c(n1)nn(c1ccc(cc1)OC)c2N)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2348 |
| logD: | 5.2346 |
| logSw: | -5.8799 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.052 |
| InChI Key: | CQLSFVXULNBCFJ-INIZCTEOSA-N |