4-(4-chlorophenyl)-6-{[(furan-2-yl)methyl]amino}-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-(4-chlorophenyl)-6-{[(furan-2-yl)methyl]amino}-2-(methylsulfanyl)pyrimidine-5-carbonitrile
4-(4-chlorophenyl)-6-{[(furan-2-yl)methyl]amino}-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D490-0288 |
| Compound Name: | 4-(4-chlorophenyl)-6-{[(furan-2-yl)methyl]amino}-2-(methylsulfanyl)pyrimidine-5-carbonitrile |
| Molecular Weight: | 356.83 |
| Molecular Formula: | C17 H13 Cl N4 O S |
| Smiles: | CSc1nc(c2ccc(cc2)[Cl])c(C#N)c(NCc2ccco2)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.6481 |
| logD: | 4.6481 |
| logSw: | -5.0797 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.71 |
| InChI Key: | NAOCNTJVBXGOIV-UHFFFAOYSA-N |