ethyl 1-[1-(4-chlorophenyl)-6-methyl-7-oxo-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidine-3-carbonyl]piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-[1-(4-chlorophenyl)-6-methyl-7-oxo-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidine-3-carbonyl]piperidine-4-carboxylate
ethyl 1-[1-(4-chlorophenyl)-6-methyl-7-oxo-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidine-3-carbonyl]piperidine-4-carboxylate
Compound characteristics
| Compound ID: | L090-0466 |
| Compound Name: | ethyl 1-[1-(4-chlorophenyl)-6-methyl-7-oxo-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidine-3-carbonyl]piperidine-4-carboxylate |
| Molecular Weight: | 443.89 |
| Molecular Formula: | C21 H22 Cl N5 O4 |
| Smiles: | CCOC(C1CCN(CC1)C(c1c2c(C(N(C)C=N2)=O)n(c2ccc(cc2)[Cl])n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6133 |
| logD: | 1.6133 |
| logSw: | -2.4649 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 75.728 |
| InChI Key: | MCIQYZZSTYYFNH-UHFFFAOYSA-N |