5-chloro-4,6-dimethyl-2-{[(5-nitrofuran-2-yl)methyl]sulfanyl}pyridine-3-carbonitrile
Chemical Structure Depiction of
5-chloro-4,6-dimethyl-2-{[(5-nitrofuran-2-yl)methyl]sulfanyl}pyridine-3-carbonitrile
5-chloro-4,6-dimethyl-2-{[(5-nitrofuran-2-yl)methyl]sulfanyl}pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 8012-5600 |
| Compound Name: | 5-chloro-4,6-dimethyl-2-{[(5-nitrofuran-2-yl)methyl]sulfanyl}pyridine-3-carbonitrile |
| Molecular Weight: | 323.75 |
| Molecular Formula: | C13 H10 Cl N3 O3 S |
| Smiles: | Cc1c(C#N)c(nc(C)c1[Cl])SCc1ccc([N+]([O-])=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.7915 |
| logD: | 3.7915 |
| logSw: | -4.8832 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 68.178 |
| InChI Key: | TYKQFNANHRXIJE-UHFFFAOYSA-N |