2-[(3-benzyl-4-oxo-3,4-dihydropteridin-2-yl)sulfanyl]-N-(3-methylphenyl)acetamide
Chemical Structure Depiction of
2-[(3-benzyl-4-oxo-3,4-dihydropteridin-2-yl)sulfanyl]-N-(3-methylphenyl)acetamide
2-[(3-benzyl-4-oxo-3,4-dihydropteridin-2-yl)sulfanyl]-N-(3-methylphenyl)acetamide
Compound characteristics
| Compound ID: | E196-0027 |
| Compound Name: | 2-[(3-benzyl-4-oxo-3,4-dihydropteridin-2-yl)sulfanyl]-N-(3-methylphenyl)acetamide |
| Molecular Weight: | 417.49 |
| Molecular Formula: | C22 H19 N5 O2 S |
| Smiles: | Cc1cccc(c1)NC(CSC1=Nc2c(C(N1Cc1ccccc1)=O)nccn2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4273 |
| logD: | 3.4273 |
| logSw: | -3.7383 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.453 |
| InChI Key: | YXXSZKHWZNAIFO-UHFFFAOYSA-N |