2-({4-[5-(tert-butylamino)-6-(3-methylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl}methyl)benzonitrile
Chemical Structure Depiction of
2-({4-[5-(tert-butylamino)-6-(3-methylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl}methyl)benzonitrile
2-({4-[5-(tert-butylamino)-6-(3-methylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl}methyl)benzonitrile
Compound characteristics
| Compound ID: | L532-2425 |
| Compound Name: | 2-({4-[5-(tert-butylamino)-6-(3-methylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl}methyl)benzonitrile |
| Molecular Weight: | 485.65 |
| Molecular Formula: | C27 H31 N7 S |
| Smiles: | Cc1cccc(c1)c1c(NC(C)(C)C)n2c(n1)sc(n2)N1CCN(CC1)Cc1ccccc1C#N |
| Stereo: | ACHIRAL |
| logP: | 5.5471 |
| logD: | 5.5248 |
| logSw: | -5.7722 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.377 |
| InChI Key: | BSSBGFAASGAQDK-UHFFFAOYSA-N |