3-({4-[5-(tert-butylamino)-6-phenylimidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl}methyl)benzonitrile
Chemical Structure Depiction of
3-({4-[5-(tert-butylamino)-6-phenylimidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl}methyl)benzonitrile
3-({4-[5-(tert-butylamino)-6-phenylimidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl}methyl)benzonitrile
Compound characteristics
| Compound ID: | L532-2317 |
| Compound Name: | 3-({4-[5-(tert-butylamino)-6-phenylimidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl}methyl)benzonitrile |
| Molecular Weight: | 471.63 |
| Molecular Formula: | C26 H29 N7 S |
| Smiles: | CC(C)(C)Nc1c(c2ccccc2)nc2n1nc(N1CCN(CC1)Cc1cccc(C#N)c1)s2 |
| Stereo: | ACHIRAL |
| logP: | 4.7397 |
| logD: | 4.7293 |
| logSw: | -4.4952 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.377 |
| InChI Key: | SIBUZNNXXMAOHW-UHFFFAOYSA-N |