1-(4-chlorophenyl)-5-(2-{[(furan-2-yl)methyl]sulfamoyl}-4-[(thiophene-2-carbonyl)amino]phenoxy)-4-methyl-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
1-(4-chlorophenyl)-5-(2-{[(furan-2-yl)methyl]sulfamoyl}-4-[(thiophene-2-carbonyl)amino]phenoxy)-4-methyl-1H-pyrazole-3-carboxylic acid
1-(4-chlorophenyl)-5-(2-{[(furan-2-yl)methyl]sulfamoyl}-4-[(thiophene-2-carbonyl)amino]phenoxy)-4-methyl-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | V030-0086 |
| Compound Name: | 1-(4-chlorophenyl)-5-(2-{[(furan-2-yl)methyl]sulfamoyl}-4-[(thiophene-2-carbonyl)amino]phenoxy)-4-methyl-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 613.07 |
| Molecular Formula: | C27 H21 Cl N4 O7 S2 |
| Salt: | not_available |
| Smiles: | Cc1c(C(O)=O)nn(c2ccc(cc2)[Cl])c1Oc1ccc(cc1S(NCc1ccco1)(=O)=O)NC(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1048 |
| logD: | 0.5888 |
| logSw: | -5.12 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 123.225 |
| InChI Key: | MWHCLWRGNZYBLW-UHFFFAOYSA-N |