N-benzyl-4-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-phenylbutanamide
Chemical Structure Depiction of
N-benzyl-4-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-phenylbutanamide
N-benzyl-4-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-phenylbutanamide
Compound characteristics
| Compound ID: | C163-0075 |
| Compound Name: | N-benzyl-4-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-phenylbutanamide |
| Molecular Weight: | 412.87 |
| Molecular Formula: | C21 H21 Cl N4 O3 |
| Smiles: | Cc1c(c(nn1CCCC(N(Cc1ccccc1)c1ccccc1)=O)[N+]([O-])=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.9054 |
| logD: | 3.9054 |
| logSw: | -4.3926 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.332 |
| InChI Key: | WFXSMDRWPCHBRL-UHFFFAOYSA-N |