2-amino-4-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-6-(methylsulfanyl)pyrimidine-5-carbonitrile
Chemical Structure Depiction of
2-amino-4-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-6-(methylsulfanyl)pyrimidine-5-carbonitrile
2-amino-4-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-6-(methylsulfanyl)pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | 8001-8078 |
| Compound Name: | 2-amino-4-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-6-(methylsulfanyl)pyrimidine-5-carbonitrile |
| Molecular Weight: | 296.41 |
| Molecular Formula: | C12 H16 N4 O S2 |
| Smiles: | CC(C)(C)C(CSc1c(C#N)c(nc(N)n1)SC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7547 |
| logD: | 2.7547 |
| logSw: | -2.8405 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.842 |
| InChI Key: | WBZSEWDRNHRKSM-UHFFFAOYSA-N |