1-(2,5-dimethylphenyl)-4-methyl-5-(2-{[2-(pyridin-2-yl)ethyl]sulfamoyl}-4-[(thiophene-2-carbonyl)amino]phenoxy)-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
1-(2,5-dimethylphenyl)-4-methyl-5-(2-{[2-(pyridin-2-yl)ethyl]sulfamoyl}-4-[(thiophene-2-carbonyl)amino]phenoxy)-1H-pyrazole-3-carboxylic acid
1-(2,5-dimethylphenyl)-4-methyl-5-(2-{[2-(pyridin-2-yl)ethyl]sulfamoyl}-4-[(thiophene-2-carbonyl)amino]phenoxy)-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | V003-9879 |
| Compound Name: | 1-(2,5-dimethylphenyl)-4-methyl-5-(2-{[2-(pyridin-2-yl)ethyl]sulfamoyl}-4-[(thiophene-2-carbonyl)amino]phenoxy)-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 631.73 |
| Molecular Formula: | C31 H29 N5 O6 S2 |
| Salt: | not_available |
| Smiles: | Cc1ccc(C)c(c1)n1c(c(C)c(C(O)=O)n1)Oc1ccc(cc1S(NCCc1ccccn1)(=O)=O)NC(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2043 |
| logD: | 0.6884 |
| logSw: | -4.815 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 124.56 |
| InChI Key: | IGESNQCGPFCRFP-UHFFFAOYSA-N |