2-({3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-3,4-dihydropteridin-2-yl}sulfanyl)-N-(3-methyl-1H-pyrazol-5-yl)acetamide
Chemical Structure Depiction of
2-({3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-3,4-dihydropteridin-2-yl}sulfanyl)-N-(3-methyl-1H-pyrazol-5-yl)acetamide
2-({3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-3,4-dihydropteridin-2-yl}sulfanyl)-N-(3-methyl-1H-pyrazol-5-yl)acetamide
Compound characteristics
| Compound ID: | E196-0281 |
| Compound Name: | 2-({3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-3,4-dihydropteridin-2-yl}sulfanyl)-N-(3-methyl-1H-pyrazol-5-yl)acetamide |
| Molecular Weight: | 481.53 |
| Molecular Formula: | C22 H23 N7 O4 S |
| Smiles: | Cc1cc(NC(CSC2=Nc3c(C(N2CCc2ccc(c(c2)OC)OC)=O)nccn3)=O)[nH]n1 |
| Stereo: | ACHIRAL |
| logP: | 1.1523 |
| logD: | 1.152 |
| logSw: | -2.315 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 106.827 |
| InChI Key: | BMIUIZDWDVJAJN-UHFFFAOYSA-N |