N-(2,3-dihydro-1H-inden-5-yl)-1-methyl-4-nitro-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-(2,3-dihydro-1H-inden-5-yl)-1-methyl-4-nitro-1H-pyrazole-5-carboxamide
N-(2,3-dihydro-1H-inden-5-yl)-1-methyl-4-nitro-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y501-3346 |
| Compound Name: | N-(2,3-dihydro-1H-inden-5-yl)-1-methyl-4-nitro-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 286.29 |
| Molecular Formula: | C14 H14 N4 O3 |
| Smiles: | Cn1c(C(Nc2ccc3CCCc3c2)=O)c(cn1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.2712 |
| logD: | 2.2532 |
| logSw: | -2.9144 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.213 |
| InChI Key: | OYJRWGUFASJSRJ-UHFFFAOYSA-N |