N-[4-({2,4,6-trioxo-1-[(pyridin-3-yl)methyl]-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-({2,4,6-trioxo-1-[(pyridin-3-yl)methyl]-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl}sulfamoyl)phenyl]acetamide
N-[4-({2,4,6-trioxo-1-[(pyridin-3-yl)methyl]-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl}sulfamoyl)phenyl]acetamide
Compound characteristics
| Compound ID: | 8019-1528 |
| Compound Name: | N-[4-({2,4,6-trioxo-1-[(pyridin-3-yl)methyl]-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl}sulfamoyl)phenyl]acetamide |
| Molecular Weight: | 538.46 |
| Molecular Formula: | C21 H17 F3 N6 O6 S |
| Smiles: | CC(Nc1ccc(cc1)S(NC1(C2=C(NC1=O)N(Cc1cccnc1)C(NC2=O)=O)C(F)(F)F)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.4115 |
| logD: | -3.1827 |
| logSw: | -2.092 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 140.552 |
| InChI Key: | QOZRKGQBAWMURF-FQEVSTJZSA-N |