2-(1,3-dimethyl-1H-pyrazol-4-yl)-4,6-dinitro-1H-indole
Chemical Structure Depiction of
2-(1,3-dimethyl-1H-pyrazol-4-yl)-4,6-dinitro-1H-indole
2-(1,3-dimethyl-1H-pyrazol-4-yl)-4,6-dinitro-1H-indole
Compound characteristics
| Compound ID: | 6049-1718 |
| Compound Name: | 2-(1,3-dimethyl-1H-pyrazol-4-yl)-4,6-dinitro-1H-indole |
| Molecular Weight: | 301.26 |
| Molecular Formula: | C13 H11 N5 O4 |
| Smiles: | Cc1c(cn(C)n1)c1cc2c(cc(cc2[nH]1)[N+]([O-])=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.3174 |
| logD: | 2.3174 |
| logSw: | -2.6587 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.94 |
| InChI Key: | OQOARZVBERCMIT-UHFFFAOYSA-N |