2-amino-4-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-6-(methylsulfanyl)pyrimidine-5-carbonitrile
Chemical Structure Depiction of
2-amino-4-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-6-(methylsulfanyl)pyrimidine-5-carbonitrile
2-amino-4-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-6-(methylsulfanyl)pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | 8003-4546 |
| Compound Name: | 2-amino-4-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-6-(methylsulfanyl)pyrimidine-5-carbonitrile |
| Molecular Weight: | 340.83 |
| Molecular Formula: | C13 H10 Cl F N4 S2 |
| Smiles: | CSc1c(C#N)c(nc(N)n1)SCc1c(cccc1[Cl])F |
| Stereo: | ACHIRAL |
| logP: | 3.9776 |
| logD: | 3.9776 |
| logSw: | -4.5902 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.323 |
| InChI Key: | UDTZKHUYJYMNBP-UHFFFAOYSA-N |