3-({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
3-({4-[5-(tert-butylamino)-6-(4-ethylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl}methyl)benzonitrile
3-({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: | L532-1838 |
| Compound Name: | 3-({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)Cc1cccc(C#N)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.7754 |
| logD: | 5.765 |
| logSw: | -5.6793 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.377 |
| InChI Key: | CCIISOUNIXXFSQ-UHFFFAOYSA-N |