4-({4-[5-(tert-butylamino)-6-(4-ethylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl}methyl)benzonitrile
Chemical Structure Depiction of
4-({4-[5-(tert-butylamino)-6-(4-ethylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl}methyl)benzonitrile
4-({4-[5-(tert-butylamino)-6-(4-ethylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl}methyl)benzonitrile
Compound characteristics
Compound ID: | L532-1836 |
Compound Name: | 4-({4-[5-(tert-butylamino)-6-(4-ethylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl}methyl)benzonitrile |
Molecular Weight: | 499.68 |
Molecular Formula: | C28 H33 N7 S |
Smiles: | CCc1ccc(cc1)c1c(NC(C)(C)C)n2c(n1)sc(n2)N1CCN(CC1)Cc1ccc(C#N)cc1 |
Stereo: | ACHIRAL |
logP: | 5.8553 |
logD: | 5.7978 |
logSw: | -5.612 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 54.377 |
InChI Key: | SLJXQSZVBKGQLD-UHFFFAOYSA-N |