4-hydroxy-6-(4-methylphenyl)-2-sulfanylpyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-hydroxy-6-(4-methylphenyl)-2-sulfanylpyrimidine-5-carbonitrile
4-hydroxy-6-(4-methylphenyl)-2-sulfanylpyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | 8015-2199 |
| Compound Name: | 4-hydroxy-6-(4-methylphenyl)-2-sulfanylpyrimidine-5-carbonitrile |
| Molecular Weight: | 243.28 |
| Molecular Formula: | C12 H9 N3 O S |
| Smiles: | Cc1ccc(cc1)c1c(C#N)c(nc(n1)S)O |
| Stereo: | ACHIRAL |
| logP: | 2.1596 |
| logD: | -2.159 |
| logSw: | -2.8182 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.041 |
| InChI Key: | KWPORPUTWFECTQ-UHFFFAOYSA-N |