2-(methylsulfanyl)-4-[3-(methylsulfanyl)anilino]-6-phenylpyrimidine-5-carbonitrile
Chemical Structure Depiction of
2-(methylsulfanyl)-4-[3-(methylsulfanyl)anilino]-6-phenylpyrimidine-5-carbonitrile
2-(methylsulfanyl)-4-[3-(methylsulfanyl)anilino]-6-phenylpyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D490-0465 |
| Compound Name: | 2-(methylsulfanyl)-4-[3-(methylsulfanyl)anilino]-6-phenylpyrimidine-5-carbonitrile |
| Molecular Weight: | 364.49 |
| Molecular Formula: | C19 H16 N4 S2 |
| Smiles: | CSc1cccc(c1)Nc1c(C#N)c(c2ccccc2)nc(n1)SC |
| Stereo: | ACHIRAL |
| logP: | 5.0888 |
| logD: | 5.0888 |
| logSw: | -5.0912 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.639 |
| InChI Key: | QZROHXYOACTYRD-UHFFFAOYSA-N |