N-[2-(3,4-diethoxybenzamido)ethyl]-3-[(3-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-diethoxybenzamido)ethyl]-3-[(3-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
N-[2-(3,4-diethoxybenzamido)ethyl]-3-[(3-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | 8018-7386 |
| Compound Name: | N-[2-(3,4-diethoxybenzamido)ethyl]-3-[(3-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 473.44 |
| Molecular Formula: | C20 H23 N7 O7 |
| Smiles: | CCOc1ccc(cc1OCC)C(NCCNC(c1nc(Cn2ccc(n2)[N+]([O-])=O)no1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.2854 |
| logD: | -0.2854 |
| logSw: | -2.0612 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 143.613 |
| InChI Key: | NKTVZCWFYNPOPJ-UHFFFAOYSA-N |