N-[(4-chloro-1-methyl-1H-pyrazol-5-yl)methyl]-3-(5-methyl-4-nitro-1H-pyrazol-1-yl)propanamide
Chemical Structure Depiction of
N-[(4-chloro-1-methyl-1H-pyrazol-5-yl)methyl]-3-(5-methyl-4-nitro-1H-pyrazol-1-yl)propanamide
N-[(4-chloro-1-methyl-1H-pyrazol-5-yl)methyl]-3-(5-methyl-4-nitro-1H-pyrazol-1-yl)propanamide
Compound characteristics
| Compound ID: | Y502-5273 |
| Compound Name: | N-[(4-chloro-1-methyl-1H-pyrazol-5-yl)methyl]-3-(5-methyl-4-nitro-1H-pyrazol-1-yl)propanamide |
| Molecular Weight: | 326.74 |
| Molecular Formula: | C12 H15 Cl N6 O3 |
| Smiles: | Cc1c(cnn1CCC(NCc1c(cnn1C)[Cl])=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.3562 |
| logD: | 0.3562 |
| logSw: | -2.3279 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.694 |
| InChI Key: | PVDWRFLSCQAUSG-UHFFFAOYSA-N |