2-ethyl-3-methyl-1-[(prop-2-en-1-yl)sulfanyl]pyrido[1,2-a]benzimidazole-4-carbonitrile
Chemical Structure Depiction of
2-ethyl-3-methyl-1-[(prop-2-en-1-yl)sulfanyl]pyrido[1,2-a]benzimidazole-4-carbonitrile
2-ethyl-3-methyl-1-[(prop-2-en-1-yl)sulfanyl]pyrido[1,2-a]benzimidazole-4-carbonitrile
Compound characteristics
Compound ID: | D724-0040 |
Compound Name: | 2-ethyl-3-methyl-1-[(prop-2-en-1-yl)sulfanyl]pyrido[1,2-a]benzimidazole-4-carbonitrile |
Molecular Weight: | 307.42 |
Molecular Formula: | C18 H17 N3 S |
Smiles: | CCc1c(C)c(C#N)c2nc3ccccc3n2c1SCC=C |
Stereo: | ACHIRAL |
logP: | 5.2919 |
logD: | 5.2919 |
logSw: | -5.5339 |
Hydrogen bond acceptors count: | 3 |
Polar surface area: | 25.358 |
InChI Key: | ISHCIOXSHUZPIK-UHFFFAOYSA-N |