N,N-dibenzyl-4-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)butanamide
Chemical Structure Depiction of
N,N-dibenzyl-4-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)butanamide
N,N-dibenzyl-4-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)butanamide
Compound characteristics
| Compound ID: | C163-0076 |
| Compound Name: | N,N-dibenzyl-4-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)butanamide |
| Molecular Weight: | 426.9 |
| Molecular Formula: | C22 H23 Cl N4 O3 |
| Smiles: | Cc1c(c(nn1CCCC(N(Cc1ccccc1)Cc1ccccc1)=O)[N+]([O-])=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.2995 |
| logD: | 3.2995 |
| logSw: | -3.9222 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.92 |
| InChI Key: | BWOQIIJZDUKDPB-UHFFFAOYSA-N |