N-[2-(3-ethoxy-4-nitro-1H-pyrazol-1-yl)ethyl]-4-(2-oxopyrrolidin-1-yl)benzene-1-sulfonamide
Chemical Structure Depiction of
N-[2-(3-ethoxy-4-nitro-1H-pyrazol-1-yl)ethyl]-4-(2-oxopyrrolidin-1-yl)benzene-1-sulfonamide
N-[2-(3-ethoxy-4-nitro-1H-pyrazol-1-yl)ethyl]-4-(2-oxopyrrolidin-1-yl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | Y504-5385 |
| Compound Name: | N-[2-(3-ethoxy-4-nitro-1H-pyrazol-1-yl)ethyl]-4-(2-oxopyrrolidin-1-yl)benzene-1-sulfonamide |
| Molecular Weight: | 423.45 |
| Molecular Formula: | C17 H21 N5 O6 S |
| Smiles: | CCOc1c(cn(CCNS(c2ccc(cc2)N2CCCC2=O)(=O)=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.889 |
| logD: | 1.8887 |
| logSw: | -2.6724 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 114.148 |
| InChI Key: | XWLLMINNGOOASX-UHFFFAOYSA-N |