5-{2-[(butan-2-yl)sulfamoyl]-4-nitrophenoxy}-1-ethyl-4-methyl-N-[(pyridin-3-yl)methyl]-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
5-{2-[(butan-2-yl)sulfamoyl]-4-nitrophenoxy}-1-ethyl-4-methyl-N-[(pyridin-3-yl)methyl]-1H-pyrazole-3-carboxamide
5-{2-[(butan-2-yl)sulfamoyl]-4-nitrophenoxy}-1-ethyl-4-methyl-N-[(pyridin-3-yl)methyl]-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | V005-0115 |
| Compound Name: | 5-{2-[(butan-2-yl)sulfamoyl]-4-nitrophenoxy}-1-ethyl-4-methyl-N-[(pyridin-3-yl)methyl]-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 516.58 |
| Molecular Formula: | C23 H28 N6 O6 S |
| Salt: | not_available |
| Smiles: | CCC(C)NS(c1cc(ccc1Oc1c(C)c(C(NCc2cccnc2)=O)nn1CC)[N+]([O-])=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5639 |
| logD: | 2.5636 |
| logSw: | -2.6957 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 130.058 |
| InChI Key: | UPCMJCPURUCPNC-HNNXBMFYSA-N |