methyl 2-{[1-(4-acetamido-3-methyl-1-phenyl-1H-pyrazol-5-yl)piperidine-4-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 2-{[1-(4-acetamido-3-methyl-1-phenyl-1H-pyrazol-5-yl)piperidine-4-carbonyl]amino}benzoate
methyl 2-{[1-(4-acetamido-3-methyl-1-phenyl-1H-pyrazol-5-yl)piperidine-4-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | G785-0058 |
| Compound Name: | methyl 2-{[1-(4-acetamido-3-methyl-1-phenyl-1H-pyrazol-5-yl)piperidine-4-carbonyl]amino}benzoate |
| Molecular Weight: | 475.55 |
| Molecular Formula: | C26 H29 N5 O4 |
| Smiles: | CC(Nc1c(C)nn(c2ccccc2)c1N1CCC(CC1)C(Nc1ccccc1C(=O)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1902 |
| logD: | 2.1219 |
| logSw: | -2.9872 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.348 |
| InChI Key: | MYQKQCZUYXZUAQ-UHFFFAOYSA-N |