N-cyclopentyl-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-cyclopentyl-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-cyclopentyl-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: | C094-1633 |
| Compound Name: | N-cyclopentyl-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: | 630.87 |
| Molecular Formula: | C38 H54 N4 O4 |
| Smiles: | CCC(C)(C(NC1CCCC1)=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: | 6.6068 |
| logD: | 6.6067 |
| logSw: | -5.4572 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.838 |
| InChI Key: | DJIKOHZEUONXCZ-LHEWISCISA-N |