2-hydroxy-6-methyl-5-{4-[3-(trifluoromethyl)phenyl]piperazine-1-sulfonyl}pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-hydroxy-6-methyl-5-{4-[3-(trifluoromethyl)phenyl]piperazine-1-sulfonyl}pyrimidin-4(3H)-one
2-hydroxy-6-methyl-5-{4-[3-(trifluoromethyl)phenyl]piperazine-1-sulfonyl}pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | D668-0361 |
| Compound Name: | 2-hydroxy-6-methyl-5-{4-[3-(trifluoromethyl)phenyl]piperazine-1-sulfonyl}pyrimidin-4(3H)-one |
| Molecular Weight: | 418.39 |
| Molecular Formula: | C16 H17 F3 N4 O4 S |
| Smiles: | CC1=C(C(NC(=N1)O)=O)S(N1CCN(CC1)c1cccc(c1)C(F)(F)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.715 |
| logD: | -5.9219 |
| logSw: | -2.3044 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.99 |
| InChI Key: | VSNSKGPLHNREFC-UHFFFAOYSA-N |