4-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-(2-chloropyridin-3-yl)butanamide
Chemical Structure Depiction of
4-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-(2-chloropyridin-3-yl)butanamide
4-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-(2-chloropyridin-3-yl)butanamide
Compound characteristics
| Compound ID: | C163-0022 |
| Compound Name: | 4-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-(2-chloropyridin-3-yl)butanamide |
| Molecular Weight: | 358.18 |
| Molecular Formula: | C13 H13 Cl2 N5 O3 |
| Smiles: | Cc1c(c(nn1CCCC(Nc1cccnc1[Cl])=O)[N+]([O-])=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 1.1266 |
| logD: | 1.1247 |
| logSw: | -2.9257 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.373 |
| InChI Key: | NGNNAHCKHJQZDA-UHFFFAOYSA-N |