N-(2-methoxyethyl)-4-methyl-5-(2-nitrophenoxy)-1-phenyl-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-(2-methoxyethyl)-4-methyl-5-(2-nitrophenoxy)-1-phenyl-1H-pyrazole-3-carboxamide
N-(2-methoxyethyl)-4-methyl-5-(2-nitrophenoxy)-1-phenyl-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | V017-1401 |
| Compound Name: | N-(2-methoxyethyl)-4-methyl-5-(2-nitrophenoxy)-1-phenyl-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 396.4 |
| Molecular Formula: | C20 H20 N4 O5 |
| Smiles: | Cc1c(C(NCCOC)=O)nn(c2ccccc2)c1Oc1ccccc1[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.9545 |
| logD: | 2.9545 |
| logSw: | -3.5872 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.15 |
| InChI Key: | WBFTWSGQKHIFGW-UHFFFAOYSA-N |