ethyl 2-{[1-(2,4-dimethylphenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carbonyl]amino}benzoate--hydrogen chloride (1/1)
Chemical Structure Depiction of
ethyl 2-{[1-(2,4-dimethylphenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carbonyl]amino}benzoate--hydrogen chloride (1/1)
ethyl 2-{[1-(2,4-dimethylphenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carbonyl]amino}benzoate--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | G362-0567 |
| Compound Name: | ethyl 2-{[1-(2,4-dimethylphenyl)-5-(piperidin-4-yl)-1H-pyrazole-4-carbonyl]amino}benzoate--hydrogen chloride (1/1) |
| Molecular Weight: | 483.01 |
| Molecular Formula: | C26 H30 N4 O3 |
| Salt: | HCl |
| Smiles: | CCOC(c1ccccc1NC(c1cnn(c2ccc(C)cc2C)c1C1CCNCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.143 |
| logD: | 0.662 |
| logSw: | -4.0593 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.06 |
| InChI Key: | BIUZZDHIZIBWER-UHFFFAOYSA-N |