2-amino-4-(methylsulfanyl)-6-[(2-oxo-2-phenylethyl)sulfanyl]pyrimidine-5-carbonitrile
Chemical Structure Depiction of
2-amino-4-(methylsulfanyl)-6-[(2-oxo-2-phenylethyl)sulfanyl]pyrimidine-5-carbonitrile
2-amino-4-(methylsulfanyl)-6-[(2-oxo-2-phenylethyl)sulfanyl]pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | 8001-8265 |
| Compound Name: | 2-amino-4-(methylsulfanyl)-6-[(2-oxo-2-phenylethyl)sulfanyl]pyrimidine-5-carbonitrile |
| Molecular Weight: | 316.4 |
| Molecular Formula: | C14 H12 N4 O S2 |
| Smiles: | CSc1c(C#N)c(nc(N)n1)SCC(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6486 |
| logD: | 2.6486 |
| logSw: | -2.8997 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.57 |
| InChI Key: | VDOHHHMFBNIKOC-UHFFFAOYSA-N |