N,N'-[methylenebis(2-cyano-4,1-phenylene)]bis{2-[(pyridin-2-yl)sulfanyl]acetamide}
Chemical Structure Depiction of
N,N'-[methylenebis(2-cyano-4,1-phenylene)]bis{2-[(pyridin-2-yl)sulfanyl]acetamide}
N,N'-[methylenebis(2-cyano-4,1-phenylene)]bis{2-[(pyridin-2-yl)sulfanyl]acetamide}
Compound characteristics
| Compound ID: | 8006-4982 |
| Compound Name: | N,N'-[methylenebis(2-cyano-4,1-phenylene)]bis{2-[(pyridin-2-yl)sulfanyl]acetamide} |
| Molecular Weight: | 550.66 |
| Molecular Formula: | C29 H22 N6 O2 S2 |
| Smiles: | C(c1ccc(c(C#N)c1)NC(CSc1ccccn1)=O)c1ccc(c(C#N)c1)NC(CSc1ccccn1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6007 |
| logD: | 3.5999 |
| logSw: | -3.861 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 95.257 |
| InChI Key: | VQGSFCGDQQJNFX-UHFFFAOYSA-N |