2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-(4-iodo-2-methylphenyl)acetamide
Chemical Structure Depiction of
2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-(4-iodo-2-methylphenyl)acetamide
2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-(4-iodo-2-methylphenyl)acetamide
Compound characteristics
| Compound ID: | 8016-8447 |
| Compound Name: | 2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-(4-iodo-2-methylphenyl)acetamide |
| Molecular Weight: | 479.07 |
| Molecular Formula: | C13 H12 Br I N4 O3 |
| Smiles: | Cc1cc(ccc1NC(Cn1c(C)c(c(n1)[N+]([O-])=O)[Br])=O)I |
| Stereo: | ACHIRAL |
| logP: | 3.5846 |
| logD: | 3.5842 |
| logSw: | -3.7447 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.709 |
| InChI Key: | KINMJZRLBMOAJV-UHFFFAOYSA-N |