2-[(3-benzyl-4-oxo-3,4-dihydropteridin-2-yl)sulfanyl]-N-(4-ethylphenyl)acetamide
Chemical Structure Depiction of
2-[(3-benzyl-4-oxo-3,4-dihydropteridin-2-yl)sulfanyl]-N-(4-ethylphenyl)acetamide
2-[(3-benzyl-4-oxo-3,4-dihydropteridin-2-yl)sulfanyl]-N-(4-ethylphenyl)acetamide
Compound characteristics
| Compound ID: | E196-0012 |
| Compound Name: | 2-[(3-benzyl-4-oxo-3,4-dihydropteridin-2-yl)sulfanyl]-N-(4-ethylphenyl)acetamide |
| Molecular Weight: | 431.52 |
| Molecular Formula: | C23 H21 N5 O2 S |
| Smiles: | CCc1ccc(cc1)NC(CSC1=Nc2c(C(N1Cc1ccccc1)=O)nccn2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.998 |
| logD: | 3.998 |
| logSw: | -3.9604 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.453 |
| InChI Key: | OPPQSAADSULOBS-UHFFFAOYSA-N |