5-{2-[(butan-2-yl)sulfamoyl]-4-nitrophenoxy}-1-(2,3-dimethylphenyl)-4-methyl-N-[(pyridin-3-yl)methyl]-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
5-{2-[(butan-2-yl)sulfamoyl]-4-nitrophenoxy}-1-(2,3-dimethylphenyl)-4-methyl-N-[(pyridin-3-yl)methyl]-1H-pyrazole-3-carboxamide
5-{2-[(butan-2-yl)sulfamoyl]-4-nitrophenoxy}-1-(2,3-dimethylphenyl)-4-methyl-N-[(pyridin-3-yl)methyl]-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | V008-4617 |
| Compound Name: | 5-{2-[(butan-2-yl)sulfamoyl]-4-nitrophenoxy}-1-(2,3-dimethylphenyl)-4-methyl-N-[(pyridin-3-yl)methyl]-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 592.67 |
| Molecular Formula: | C29 H32 N6 O6 S |
| Salt: | not_available |
| Smiles: | CCC(C)NS(c1cc(ccc1Oc1c(C)c(C(NCc2cccnc2)=O)nn1c1cccc(C)c1C)[N+]([O-])=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8101 |
| logD: | 4.8097 |
| logSw: | -4.3933 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 129.897 |
| InChI Key: | NESQDMAGGGJHKC-IBGZPJMESA-N |