N-(4-bromophenyl)-4-(5-methyl-3-nitro-1H-pyrazol-1-yl)butanamide
Chemical Structure Depiction of
N-(4-bromophenyl)-4-(5-methyl-3-nitro-1H-pyrazol-1-yl)butanamide
N-(4-bromophenyl)-4-(5-methyl-3-nitro-1H-pyrazol-1-yl)butanamide
Compound characteristics
| Compound ID: | C163-0145 |
| Compound Name: | N-(4-bromophenyl)-4-(5-methyl-3-nitro-1H-pyrazol-1-yl)butanamide |
| Molecular Weight: | 367.2 |
| Molecular Formula: | C14 H15 Br N4 O3 |
| Smiles: | Cc1cc(nn1CCCC(Nc1ccc(cc1)[Br])=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.0053 |
| logD: | 2.0046 |
| logSw: | -2.6731 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.14 |
| InChI Key: | WQOQGFFLGOURRW-UHFFFAOYSA-N |