2-amino-6-{[2-(3,4-dichlorophenyl)-2-oxoethyl]sulfanyl}-4-(propan-2-yl)pyridine-3,5-dicarbonitrile
Chemical Structure Depiction of
2-amino-6-{[2-(3,4-dichlorophenyl)-2-oxoethyl]sulfanyl}-4-(propan-2-yl)pyridine-3,5-dicarbonitrile
2-amino-6-{[2-(3,4-dichlorophenyl)-2-oxoethyl]sulfanyl}-4-(propan-2-yl)pyridine-3,5-dicarbonitrile
Compound characteristics
| Compound ID: | 0892-0507 |
| Compound Name: | 2-amino-6-{[2-(3,4-dichlorophenyl)-2-oxoethyl]sulfanyl}-4-(propan-2-yl)pyridine-3,5-dicarbonitrile |
| Molecular Weight: | 405.3 |
| Molecular Formula: | C18 H14 Cl2 N4 O S |
| Smiles: | CC(C)c1c(C#N)c(N)nc(c1C#N)SCC(c1ccc(c(c1)[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.8324 |
| logD: | 4.8324 |
| logSw: | -5.0066 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.77 |
| InChI Key: | VHUUATGHVIFXGY-UHFFFAOYSA-N |