5-[2-{[(furan-2-yl)methyl]sulfamoyl}-4-(2-methylbutanamido)phenoxy]-4-methyl-1-(4-methylphenyl)-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
5-[2-{[(furan-2-yl)methyl]sulfamoyl}-4-(2-methylbutanamido)phenoxy]-4-methyl-1-(4-methylphenyl)-1H-pyrazole-3-carboxylic acid
5-[2-{[(furan-2-yl)methyl]sulfamoyl}-4-(2-methylbutanamido)phenoxy]-4-methyl-1-(4-methylphenyl)-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | V008-1816 |
| Compound Name: | 5-[2-{[(furan-2-yl)methyl]sulfamoyl}-4-(2-methylbutanamido)phenoxy]-4-methyl-1-(4-methylphenyl)-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 566.63 |
| Molecular Formula: | C28 H30 N4 O7 S |
| Salt: | not_available |
| Smiles: | CCC(C)C(Nc1ccc(c(c1)S(NCc1ccco1)(=O)=O)Oc1c(C)c(C(O)=O)nn1c1ccc(C)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7487 |
| logD: | 0.2328 |
| logSw: | -4.3671 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 122.478 |
| InChI Key: | NEHLBFFLZWCILX-SFHVURJKSA-N |