N-(4-bromophenyl)-4-nitro-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-(4-bromophenyl)-4-nitro-1H-pyrazole-3-carboxamide
N-(4-bromophenyl)-4-nitro-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y501-3352 |
| Compound Name: | N-(4-bromophenyl)-4-nitro-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 311.09 |
| Molecular Formula: | C10 H7 Br N4 O3 |
| Smiles: | c1cc(ccc1NC(c1c(c[nH]n1)[N+]([O-])=O)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.5208 |
| logD: | 2.3052 |
| logSw: | -3.0482 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.872 |
| InChI Key: | RKPKBDYUWISQLL-UHFFFAOYSA-N |