N-(4-fluorophenyl)-N-[(5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]benzenesulfonamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-N-[(5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]benzenesulfonamide
N-(4-fluorophenyl)-N-[(5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]benzenesulfonamide
Compound characteristics
| Compound ID: | D433-0897 |
| Compound Name: | N-(4-fluorophenyl)-N-[(5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]benzenesulfonamide |
| Molecular Weight: | 413.43 |
| Molecular Formula: | C19 H16 F N5 O3 S |
| Smiles: | CC1=CC(n2c(N1)nc(CN(c1ccc(cc1)F)S(c1ccccc1)(=O)=O)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1675 |
| logD: | -0.2197 |
| logSw: | -2.82 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.549 |
| InChI Key: | DLUSQJULDZCVIH-UHFFFAOYSA-N |