4-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-N-cycloheptylbenzamide
Chemical Structure Depiction of
4-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-N-cycloheptylbenzamide
4-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-N-cycloheptylbenzamide
Compound characteristics
| Compound ID: | Y502-9533 |
| Compound Name: | 4-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-N-cycloheptylbenzamide |
| Molecular Weight: | 376.84 |
| Molecular Formula: | C18 H21 Cl N4 O3 |
| Smiles: | C1CCCC(CC1)NC(c1ccc(Cn2cc(c(n2)[N+]([O-])=O)[Cl])cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6981 |
| logD: | 3.6981 |
| logSw: | -4.2028 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.304 |
| InChI Key: | LEWGRFDYLVNUMK-UHFFFAOYSA-N |