N-cyclohexyl-N~2~-[3-(3,5-di-tert-butyl-4-hydroxyphenyl)propanoyl]-N~2~-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)isovalinamide
Chemical Structure Depiction of
N-cyclohexyl-N~2~-[3-(3,5-di-tert-butyl-4-hydroxyphenyl)propanoyl]-N~2~-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)isovalinamide
N-cyclohexyl-N~2~-[3-(3,5-di-tert-butyl-4-hydroxyphenyl)propanoyl]-N~2~-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)isovalinamide
Compound characteristics
| Compound ID: | C094-1729 |
| Compound Name: | N-cyclohexyl-N~2~-[3-(3,5-di-tert-butyl-4-hydroxyphenyl)propanoyl]-N~2~-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)isovalinamide |
| Molecular Weight: | 644.9 |
| Molecular Formula: | C39 H56 N4 O4 |
| Smiles: | CCC(C)(C(NC1CCCCC1)=O)N(C1=C(C)N(C)N(C1=O)c1ccccc1)C(CCc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.0621 |
| logD: | 7.0621 |
| logSw: | -5.4405 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.472 |
| InChI Key: | JJCBDRUPILHTPO-KDXMTYKHSA-N |