2-[{[(5-chloro-3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]acetyl}(methyl)amino]ethyl [(3,5-dichloro-4,6-dimethylpyridin-2-yl)sulfanyl]acetate
Chemical Structure Depiction of
2-[{[(5-chloro-3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]acetyl}(methyl)amino]ethyl [(3,5-dichloro-4,6-dimethylpyridin-2-yl)sulfanyl]acetate
2-[{[(5-chloro-3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]acetyl}(methyl)amino]ethyl [(3,5-dichloro-4,6-dimethylpyridin-2-yl)sulfanyl]acetate
Compound characteristics
| Compound ID: | 8017-9902 |
| Compound Name: | 2-[{[(5-chloro-3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]acetyl}(methyl)amino]ethyl [(3,5-dichloro-4,6-dimethylpyridin-2-yl)sulfanyl]acetate |
| Molecular Weight: | 561.94 |
| Molecular Formula: | C22 H23 Cl3 N4 O3 S2 |
| Smiles: | Cc1c(C#N)c(nc(C)c1[Cl])SCC(N(C)CCOC(CSc1c(c(C)c(c(C)n1)[Cl])[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4852 |
| logD: | 5.4852 |
| logSw: | -5.9385 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 71.997 |
| InChI Key: | BIWYHHNHCKPPIC-UHFFFAOYSA-N |