1-tert-butyl-5-{2-[(2-methoxyethyl)sulfamoyl]-4-[4-methoxy-3-(trifluoromethyl)benzamido]phenoxy}-4-methyl-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
1-tert-butyl-5-{2-[(2-methoxyethyl)sulfamoyl]-4-[4-methoxy-3-(trifluoromethyl)benzamido]phenoxy}-4-methyl-1H-pyrazole-3-carboxylic acid
1-tert-butyl-5-{2-[(2-methoxyethyl)sulfamoyl]-4-[4-methoxy-3-(trifluoromethyl)benzamido]phenoxy}-4-methyl-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | V007-0177 |
| Compound Name: | 1-tert-butyl-5-{2-[(2-methoxyethyl)sulfamoyl]-4-[4-methoxy-3-(trifluoromethyl)benzamido]phenoxy}-4-methyl-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 628.62 |
| Molecular Formula: | C27 H31 F3 N4 O8 S |
| Salt: | not_available |
| Smiles: | Cc1c(C(O)=O)nn(c1Oc1ccc(cc1S(NCCOC)(=O)=O)NC(c1ccc(c(c1)C(F)(F)F)OC)=O)C(C)(C)C |
| Stereo: | ACHIRAL |
| logP: | 3.6853 |
| logD: | 0.9723 |
| logSw: | -4.1536 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 131.511 |
| InChI Key: | OCSLBKLWQGWRQU-UHFFFAOYSA-N |