ethyl 1-{4-[bis(3-methylbutyl)carbamoyl]phenyl}-5-(butan-2-yl)-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 1-{4-[bis(3-methylbutyl)carbamoyl]phenyl}-5-(butan-2-yl)-1H-pyrazole-3-carboxylate
ethyl 1-{4-[bis(3-methylbutyl)carbamoyl]phenyl}-5-(butan-2-yl)-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | V016-6173 |
| Compound Name: | ethyl 1-{4-[bis(3-methylbutyl)carbamoyl]phenyl}-5-(butan-2-yl)-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 455.64 |
| Molecular Formula: | C27 H41 N3 O3 |
| Smiles: | CCC(C)c1cc(C(=O)OCC)nn1c1ccc(cc1)C(N(CCC(C)C)CCC(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.3328 |
| logD: | 6.3328 |
| logSw: | -5.4993 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.526 |
| InChI Key: | SIPFGZCHTCOGKC-NRFANRHFSA-N |