N-cyclooctyl-5-[(4-nitro-1H-pyrazol-1-yl)methyl]furan-2-carboxamide
Chemical Structure Depiction of
N-cyclooctyl-5-[(4-nitro-1H-pyrazol-1-yl)methyl]furan-2-carboxamide
N-cyclooctyl-5-[(4-nitro-1H-pyrazol-1-yl)methyl]furan-2-carboxamide
Compound characteristics
| Compound ID: | Y500-3444 |
| Compound Name: | N-cyclooctyl-5-[(4-nitro-1H-pyrazol-1-yl)methyl]furan-2-carboxamide |
| Molecular Weight: | 346.38 |
| Molecular Formula: | C17 H22 N4 O4 |
| Smiles: | C1CCCC(CCC1)NC(c1ccc(Cn2cc(cn2)[N+]([O-])=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3721 |
| logD: | 3.3721 |
| logSw: | -3.5419 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.437 |
| InChI Key: | GJOZRAHLMDUESH-UHFFFAOYSA-N |