2-[(4-hydroxy-5,6-dimethylpyrimidin-2-yl)sulfanyl]-N-(4-nitrophenyl)acetamide
Chemical Structure Depiction of
2-[(4-hydroxy-5,6-dimethylpyrimidin-2-yl)sulfanyl]-N-(4-nitrophenyl)acetamide
2-[(4-hydroxy-5,6-dimethylpyrimidin-2-yl)sulfanyl]-N-(4-nitrophenyl)acetamide
Compound characteristics
Compound ID: | 8015-7650 |
Compound Name: | 2-[(4-hydroxy-5,6-dimethylpyrimidin-2-yl)sulfanyl]-N-(4-nitrophenyl)acetamide |
Molecular Weight: | 334.35 |
Molecular Formula: | C14 H14 N4 O4 S |
Smiles: | Cc1c(C)nc(nc1O)SCC(Nc1ccc(cc1)[N+]([O-])=O)=O |
Stereo: | ACHIRAL |
logP: | 2.3469 |
logD: | 2.3194 |
logSw: | -2.7828 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 91.328 |
InChI Key: | CGYVDJOFAZUVFX-UHFFFAOYSA-N |