1-(4-fluorophenyl)-5-{2-[(2-methoxyethyl)sulfamoyl]-4-(3-methylbutanamido)phenoxy}-4-methyl-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
1-(4-fluorophenyl)-5-{2-[(2-methoxyethyl)sulfamoyl]-4-(3-methylbutanamido)phenoxy}-4-methyl-1H-pyrazole-3-carboxylic acid
1-(4-fluorophenyl)-5-{2-[(2-methoxyethyl)sulfamoyl]-4-(3-methylbutanamido)phenoxy}-4-methyl-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | V026-5872 |
| Compound Name: | 1-(4-fluorophenyl)-5-{2-[(2-methoxyethyl)sulfamoyl]-4-(3-methylbutanamido)phenoxy}-4-methyl-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 548.59 |
| Molecular Formula: | C25 H29 F N4 O7 S |
| Salt: | not_available |
| Smiles: | CC(C)CC(Nc1ccc(c(c1)S(NCCOC)(=O)=O)Oc1c(C)c(C(O)=O)nn1c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3273 |
| logD: | -1.1887 |
| logSw: | -3.7386 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 122.972 |
| InChI Key: | FHMPWJQERFPSOZ-UHFFFAOYSA-N |