N-(4-{[1,3-dimethyl-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]sulfamoyl}phenyl)acetamide
Chemical Structure Depiction of
N-(4-{[1,3-dimethyl-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]sulfamoyl}phenyl)acetamide
N-(4-{[1,3-dimethyl-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]sulfamoyl}phenyl)acetamide
Compound characteristics
| Compound ID: | 8602-0014 |
| Compound Name: | N-(4-{[1,3-dimethyl-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]sulfamoyl}phenyl)acetamide |
| Molecular Weight: | 475.4 |
| Molecular Formula: | C17 H16 F3 N5 O6 S |
| Smiles: | CC(Nc1ccc(cc1)S(NC1(C2=C(NC1=O)N(C)C(N(C)C2=O)=O)C(F)(F)F)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.3995 |
| logD: | -3.1947 |
| logSw: | -2.3511 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 122.157 |
| InChI Key: | ADPFLXJQLMNFIT-INIZCTEOSA-N |