methyl 2-({[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]carbamoyl}sulfamoyl)benzoate
Chemical Structure Depiction of
methyl 2-({[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]carbamoyl}sulfamoyl)benzoate
methyl 2-({[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]carbamoyl}sulfamoyl)benzoate
Compound characteristics
| Compound ID: | 8014-1481 |
| Compound Name: | methyl 2-({[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]carbamoyl}sulfamoyl)benzoate |
| Molecular Weight: | 486.45 |
| Molecular Formula: | C18 H13 F3 N4 O5 S2 |
| Smiles: | COC(c1ccccc1S(NC(Nc1nc(cc(C(F)(F)F)n1)c1cccs1)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9577 |
| logD: | 1.9187 |
| logSw: | -4.1459 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 105.905 |
| InChI Key: | PXTCPMHSTHJHBQ-UHFFFAOYSA-N |