3-[2-(1,3-dimethyl-4-nitro-1H-pyrazol-5-yl)hydrazinylidene]-5-nitro-1,3-dihydro-2H-indol-2-one
Chemical Structure Depiction of
3-[2-(1,3-dimethyl-4-nitro-1H-pyrazol-5-yl)hydrazinylidene]-5-nitro-1,3-dihydro-2H-indol-2-one
3-[2-(1,3-dimethyl-4-nitro-1H-pyrazol-5-yl)hydrazinylidene]-5-nitro-1,3-dihydro-2H-indol-2-one
Compound characteristics
| Compound ID: | K017-0085 |
| Compound Name: | 3-[2-(1,3-dimethyl-4-nitro-1H-pyrazol-5-yl)hydrazinylidene]-5-nitro-1,3-dihydro-2H-indol-2-one |
| Molecular Weight: | 345.27 |
| Molecular Formula: | C13 H11 N7 O5 |
| Smiles: | Cc1c(c(N/N=C2C(Nc3ccc(cc\23)[N+]([O-])=O)=O)n(C)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.2489 |
| logD: | 1.2363 |
| logSw: | -2.4421 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 125.858 |
| InChI Key: | CPVVWMKBEBOMDA-UHFFFAOYSA-N |