dimethyl 5-{3-[3-(4-fluorophenyl)-2,5,7-trimethylpyrazolo[1,5-a]pyrimidin-6-yl]propanamido}benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-{3-[3-(4-fluorophenyl)-2,5,7-trimethylpyrazolo[1,5-a]pyrimidin-6-yl]propanamido}benzene-1,3-dicarboxylate
dimethyl 5-{3-[3-(4-fluorophenyl)-2,5,7-trimethylpyrazolo[1,5-a]pyrimidin-6-yl]propanamido}benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | C561-0737 |
| Compound Name: | dimethyl 5-{3-[3-(4-fluorophenyl)-2,5,7-trimethylpyrazolo[1,5-a]pyrimidin-6-yl]propanamido}benzene-1,3-dicarboxylate |
| Molecular Weight: | 518.54 |
| Molecular Formula: | C28 H27 F N4 O5 |
| Smiles: | Cc1c(CCC(Nc2cc(cc(c2)C(=O)OC)C(=O)OC)=O)c(C)n2c(c(c3ccc(cc3)F)c(C)n2)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.6495 |
| logD: | 4.6476 |
| logSw: | -4.6618 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.07 |
| InChI Key: | DLAMXFXUBUXEBI-UHFFFAOYSA-N |