4-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-N-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]benzamide
Chemical Structure Depiction of
4-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-N-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]benzamide
4-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-N-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]benzamide
Compound characteristics
| Compound ID: | Y502-9845 |
| Compound Name: | 4-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-N-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]benzamide |
| Molecular Weight: | 402.84 |
| Molecular Formula: | C18 H19 Cl N6 O3 |
| Smiles: | CCn1c(C)c(CNC(c2ccc(Cn3cc(c(n3)[N+]([O-])=O)[Cl])cc2)=O)cn1 |
| Stereo: | ACHIRAL |
| logP: | 1.9246 |
| logD: | 1.9246 |
| logSw: | -2.9854 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.173 |
| InChI Key: | BCWJMESWGSIIMX-UHFFFAOYSA-N |