ethyl 5-(2-methylphenyl)-1-(4-{[(3-methylphenyl)methyl]carbamoyl}phenyl)-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-(2-methylphenyl)-1-(4-{[(3-methylphenyl)methyl]carbamoyl}phenyl)-1H-pyrazole-3-carboxylate
ethyl 5-(2-methylphenyl)-1-(4-{[(3-methylphenyl)methyl]carbamoyl}phenyl)-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | V011-9589 |
| Compound Name: | ethyl 5-(2-methylphenyl)-1-(4-{[(3-methylphenyl)methyl]carbamoyl}phenyl)-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 453.54 |
| Molecular Formula: | C28 H27 N3 O3 |
| Smiles: | CCOC(c1cc(c2ccccc2C)n(c2ccc(cc2)C(NCc2cccc(C)c2)=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.592 |
| logD: | 5.592 |
| logSw: | -5.4471 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.229 |
| InChI Key: | FEFSHUZGZLAJLE-UHFFFAOYSA-N |