ethyl 5-(butan-2-yl)-1-{4-[(4-phenylbutan-2-yl)carbamoyl]phenyl}-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-(butan-2-yl)-1-{4-[(4-phenylbutan-2-yl)carbamoyl]phenyl}-1H-pyrazole-3-carboxylate
ethyl 5-(butan-2-yl)-1-{4-[(4-phenylbutan-2-yl)carbamoyl]phenyl}-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | V003-4935 |
| Compound Name: | ethyl 5-(butan-2-yl)-1-{4-[(4-phenylbutan-2-yl)carbamoyl]phenyl}-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 447.58 |
| Molecular Formula: | C27 H33 N3 O3 |
| Smiles: | CCC(C)c1cc(C(=O)OCC)nn1c1ccc(cc1)C(NC(C)CCc1ccccc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.226 |
| logD: | 5.226 |
| logSw: | -5.091 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.941 |
| InChI Key: | MAJSJDYVYCQBDA-UHFFFAOYSA-N |