N-(4-bromophenyl)-4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butanamide
Chemical Structure Depiction of
N-(4-bromophenyl)-4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butanamide
N-(4-bromophenyl)-4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butanamide
Compound characteristics
| Compound ID: | C163-0258 |
| Compound Name: | N-(4-bromophenyl)-4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butanamide |
| Molecular Weight: | 381.23 |
| Molecular Formula: | C15 H17 Br N4 O3 |
| Smiles: | Cc1c(c(C)n(CCCC(Nc2ccc(cc2)[Br])=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.2644 |
| logD: | 2.2638 |
| logSw: | -2.8773 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.428 |
| InChI Key: | FAGMFEZZAIRIGK-UHFFFAOYSA-N |