ethyl 1-{4-[(3,3-dimethylbutan-2-yl)carbamoyl]phenyl}-5-(3,4-dimethylphenyl)-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 1-{4-[(3,3-dimethylbutan-2-yl)carbamoyl]phenyl}-5-(3,4-dimethylphenyl)-1H-pyrazole-3-carboxylate
ethyl 1-{4-[(3,3-dimethylbutan-2-yl)carbamoyl]phenyl}-5-(3,4-dimethylphenyl)-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | V016-6148 |
| Compound Name: | ethyl 1-{4-[(3,3-dimethylbutan-2-yl)carbamoyl]phenyl}-5-(3,4-dimethylphenyl)-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 447.58 |
| Molecular Formula: | C27 H33 N3 O3 |
| Smiles: | CCOC(c1cc(c2ccc(C)c(C)c2)n(c2ccc(cc2)C(NC(C)C(C)(C)C)=O)n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.0867 |
| logD: | 6.0867 |
| logSw: | -5.43 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.663 |
| InChI Key: | DIKMAGRWQSZVKO-IBGZPJMESA-N |