ethyl 5-(3,4-dimethylphenyl)-1-(4-{[(2RS)-3-methylbutan-2-yl]carbamoyl}phenyl)-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-(3,4-dimethylphenyl)-1-(4-{[(2RS)-3-methylbutan-2-yl]carbamoyl}phenyl)-1H-pyrazole-3-carboxylate
ethyl 5-(3,4-dimethylphenyl)-1-(4-{[(2RS)-3-methylbutan-2-yl]carbamoyl}phenyl)-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | V003-1933 |
| Compound Name: | ethyl 5-(3,4-dimethylphenyl)-1-(4-{[(2RS)-3-methylbutan-2-yl]carbamoyl}phenyl)-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 433.55 |
| Molecular Formula: | C26 H31 N3 O3 |
| Smiles: | CCOC(c1cc(c2ccc(C)c(C)c2)n(c2ccc(cc2)C(N[C@H](C)C(C)C)=O)n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8722 |
| logD: | 5.8722 |
| logSw: | -5.4095 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.663 |
| InChI Key: | ZVMCVIPYTXAUPQ-IBGZPJMESA-N |