2-(methylsulfanyl)-4-{[(oxolan-2-yl)methyl]amino}-6-phenylpyrimidine-5-carbonitrile
Chemical Structure Depiction of
2-(methylsulfanyl)-4-{[(oxolan-2-yl)methyl]amino}-6-phenylpyrimidine-5-carbonitrile
2-(methylsulfanyl)-4-{[(oxolan-2-yl)methyl]amino}-6-phenylpyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D490-0478 |
| Compound Name: | 2-(methylsulfanyl)-4-{[(oxolan-2-yl)methyl]amino}-6-phenylpyrimidine-5-carbonitrile |
| Molecular Weight: | 326.42 |
| Molecular Formula: | C17 H18 N4 O S |
| Smiles: | CSc1nc(c2ccccc2)c(C#N)c(NCC2CCCO2)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0525 |
| logD: | 3.0525 |
| logSw: | -3.2195 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.615 |
| InChI Key: | BFFPCYSHRWQVAH-CYBMUJFWSA-N |