2-({4-oxo-3-[(oxolan-2-yl)methyl]-3,4-dihydropteridin-2-yl}sulfanyl)-N-[2-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
2-({4-oxo-3-[(oxolan-2-yl)methyl]-3,4-dihydropteridin-2-yl}sulfanyl)-N-[2-(trifluoromethyl)phenyl]acetamide
2-({4-oxo-3-[(oxolan-2-yl)methyl]-3,4-dihydropteridin-2-yl}sulfanyl)-N-[2-(trifluoromethyl)phenyl]acetamide
Compound characteristics
| Compound ID: | E196-0176 |
| Compound Name: | 2-({4-oxo-3-[(oxolan-2-yl)methyl]-3,4-dihydropteridin-2-yl}sulfanyl)-N-[2-(trifluoromethyl)phenyl]acetamide |
| Molecular Weight: | 465.45 |
| Molecular Formula: | C20 H18 F3 N5 O3 S |
| Smiles: | C1CC(CN2C(=Nc3c(C2=O)nccn3)SCC(Nc2ccccc2C(F)(F)F)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0257 |
| logD: | 2.0257 |
| logSw: | -2.7872 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.41 |
| InChI Key: | XAEHEUZFUSZGQQ-GFCCVEGCSA-N |