dimethyl 5-{3-[2-(4-chlorophenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]propanamido}benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-{3-[2-(4-chlorophenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]propanamido}benzene-1,3-dicarboxylate
dimethyl 5-{3-[2-(4-chlorophenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]propanamido}benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | C561-0848 |
| Compound Name: | dimethyl 5-{3-[2-(4-chlorophenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]propanamido}benzene-1,3-dicarboxylate |
| Molecular Weight: | 520.97 |
| Molecular Formula: | C27 H25 Cl N4 O5 |
| Smiles: | Cc1c(CCC(Nc2cc(cc(c2)C(=O)OC)C(=O)OC)=O)c(C)n2c(cc(c3ccc(cc3)[Cl])n2)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.4726 |
| logD: | 5.4644 |
| logSw: | -6.0027 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.946 |
| InChI Key: | SOXIGKLJJIQHQG-UHFFFAOYSA-N |