3-[(4-methylphenyl)methyl]-2-sulfanylidene-2,3-dihydropteridin-4(1H)-one
Chemical Structure Depiction of
3-[(4-methylphenyl)methyl]-2-sulfanylidene-2,3-dihydropteridin-4(1H)-one
3-[(4-methylphenyl)methyl]-2-sulfanylidene-2,3-dihydropteridin-4(1H)-one
Compound characteristics
| Compound ID: | C200-2761 |
| Compound Name: | 3-[(4-methylphenyl)methyl]-2-sulfanylidene-2,3-dihydropteridin-4(1H)-one |
| Molecular Weight: | 284.34 |
| Molecular Formula: | C14 H12 N4 O S |
| Smiles: | Cc1ccc(CN2C(c3c(NC2=S)nccn3)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.3193 |
| logD: | 2.281 |
| logSw: | -2.8361 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.85 |
| InChI Key: | KEPVIEYSNDSCCJ-UHFFFAOYSA-N |