dimethyl 5-({5-[1-(tert-butoxycarbonyl)piperidin-4-yl]-1-(4-fluorophenyl)-1H-pyrazole-4-carbonyl}amino)benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-({5-[1-(tert-butoxycarbonyl)piperidin-4-yl]-1-(4-fluorophenyl)-1H-pyrazole-4-carbonyl}amino)benzene-1,3-dicarboxylate
dimethyl 5-({5-[1-(tert-butoxycarbonyl)piperidin-4-yl]-1-(4-fluorophenyl)-1H-pyrazole-4-carbonyl}amino)benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | E955-1711 |
| Compound Name: | dimethyl 5-({5-[1-(tert-butoxycarbonyl)piperidin-4-yl]-1-(4-fluorophenyl)-1H-pyrazole-4-carbonyl}amino)benzene-1,3-dicarboxylate |
| Molecular Weight: | 580.61 |
| Molecular Formula: | C30 H33 F N4 O7 |
| Smiles: | CC(C)(C)OC(N1CCC(CC1)c1c(cnn1c1ccc(cc1)F)C(Nc1cc(cc(c1)C(=O)OC)C(=O)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4671 |
| logD: | 6.4666 |
| logSw: | -5.5898 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 100.582 |
| InChI Key: | XJTBITQINHREKG-UHFFFAOYSA-N |