N~2~-benzyl-N-[3-tert-butyl-1-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]-N~2~-[(4-nitrophenyl)carbamoyl]glycinamide
Chemical Structure Depiction of
N~2~-benzyl-N-[3-tert-butyl-1-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]-N~2~-[(4-nitrophenyl)carbamoyl]glycinamide
N~2~-benzyl-N-[3-tert-butyl-1-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]-N~2~-[(4-nitrophenyl)carbamoyl]glycinamide
Compound characteristics
| Compound ID: | V012-1885 |
| Compound Name: | N~2~-benzyl-N-[3-tert-butyl-1-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]-N~2~-[(4-nitrophenyl)carbamoyl]glycinamide |
| Molecular Weight: | 554.65 |
| Molecular Formula: | C31 H34 N6 O4 |
| Salt: | not_available |
| Smiles: | Cc1ccc(c(C)c1)n1c(cc(C(C)(C)C)n1)NC(CN(Cc1ccccc1)C(Nc1ccc(cc1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.9773 |
| logD: | 6.977 |
| logSw: | -5.5265 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 95.664 |
| InChI Key: | YGIRUVBFOBRBOT-UHFFFAOYSA-N |