5-{2-[(butan-2-yl)sulfamoyl]-4-nitrophenoxy}-1-(4-fluorophenyl)-4-methyl-N-[(pyridin-3-yl)methyl]-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
5-{2-[(butan-2-yl)sulfamoyl]-4-nitrophenoxy}-1-(4-fluorophenyl)-4-methyl-N-[(pyridin-3-yl)methyl]-1H-pyrazole-3-carboxamide
5-{2-[(butan-2-yl)sulfamoyl]-4-nitrophenoxy}-1-(4-fluorophenyl)-4-methyl-N-[(pyridin-3-yl)methyl]-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | V027-3485 |
| Compound Name: | 5-{2-[(butan-2-yl)sulfamoyl]-4-nitrophenoxy}-1-(4-fluorophenyl)-4-methyl-N-[(pyridin-3-yl)methyl]-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 582.61 |
| Molecular Formula: | C27 H27 F N6 O6 S |
| Salt: | not_available |
| Smiles: | CCC(C)NS(c1cc(ccc1Oc1c(C)c(C(NCc2cccnc2)=O)nn1c1ccc(cc1)F)[N+]([O-])=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9443 |
| logD: | 3.944 |
| logSw: | -3.7728 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 130.198 |
| InChI Key: | UVBRUUUAMHUGTO-KRWDZBQOSA-N |