2-amino-4-{[(3,4-dichlorophenyl)methyl]sulfanyl}-6-(methylsulfanyl)pyrimidine-5-carbonitrile
Chemical Structure Depiction of
2-amino-4-{[(3,4-dichlorophenyl)methyl]sulfanyl}-6-(methylsulfanyl)pyrimidine-5-carbonitrile
2-amino-4-{[(3,4-dichlorophenyl)methyl]sulfanyl}-6-(methylsulfanyl)pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | 8001-8088 |
| Compound Name: | 2-amino-4-{[(3,4-dichlorophenyl)methyl]sulfanyl}-6-(methylsulfanyl)pyrimidine-5-carbonitrile |
| Molecular Weight: | 357.28 |
| Molecular Formula: | C13 H10 Cl2 N4 S2 |
| Smiles: | CSc1c(C#N)c(nc(N)n1)SCc1ccc(c(c1)[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.5456 |
| logD: | 4.5456 |
| logSw: | -4.7798 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.323 |
| InChI Key: | NCTNTFRNPSWWAU-UHFFFAOYSA-N |