N-[(4-bromo-1-ethyl-1H-pyrazol-5-yl)methyl]-3-(5-methyl-4-nitro-1H-pyrazol-1-yl)propanamide
Chemical Structure Depiction of
N-[(4-bromo-1-ethyl-1H-pyrazol-5-yl)methyl]-3-(5-methyl-4-nitro-1H-pyrazol-1-yl)propanamide
N-[(4-bromo-1-ethyl-1H-pyrazol-5-yl)methyl]-3-(5-methyl-4-nitro-1H-pyrazol-1-yl)propanamide
Compound characteristics
| Compound ID: | Y502-5568 |
| Compound Name: | N-[(4-bromo-1-ethyl-1H-pyrazol-5-yl)methyl]-3-(5-methyl-4-nitro-1H-pyrazol-1-yl)propanamide |
| Molecular Weight: | 385.22 |
| Molecular Formula: | C13 H17 Br N6 O3 |
| Smiles: | CCn1c(CNC(CCn2c(C)c(cn2)[N+]([O-])=O)=O)c(cn1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 0.8564 |
| logD: | 0.8564 |
| logSw: | -1.5858 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.133 |
| InChI Key: | WCUAAFMTVLWGDQ-UHFFFAOYSA-N |