ethyl 5-(3,4-dimethylphenyl)-1-{4-[(2-ethylhexyl)carbamoyl]phenyl}-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-(3,4-dimethylphenyl)-1-{4-[(2-ethylhexyl)carbamoyl]phenyl}-1H-pyrazole-3-carboxylate
ethyl 5-(3,4-dimethylphenyl)-1-{4-[(2-ethylhexyl)carbamoyl]phenyl}-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | V006-6943 |
| Compound Name: | ethyl 5-(3,4-dimethylphenyl)-1-{4-[(2-ethylhexyl)carbamoyl]phenyl}-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 475.63 |
| Molecular Formula: | C29 H37 N3 O3 |
| Smiles: | CCCCC(CC)CNC(c1ccc(cc1)n1c(cc(C(=O)OCC)n1)c1ccc(C)c(C)c1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.3744 |
| logD: | 7.3744 |
| logSw: | -5.6807 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.5 |
| InChI Key: | MUUKIKZHPCPOPI-QFIPXVFZSA-N |