1-{4-[5-(tert-butylamino)-6-(3-methylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl}-2-(thiophen-2-yl)ethan-1-one
Chemical Structure Depiction of
1-{4-[5-(tert-butylamino)-6-(3-methylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl}-2-(thiophen-2-yl)ethan-1-one
1-{4-[5-(tert-butylamino)-6-(3-methylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl}-2-(thiophen-2-yl)ethan-1-one
Compound characteristics
| Compound ID: | L327-5517 |
| Compound Name: | 1-{4-[5-(tert-butylamino)-6-(3-methylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl}-2-(thiophen-2-yl)ethan-1-one |
| Molecular Weight: | 494.68 |
| Molecular Formula: | C25 H30 N6 O S2 |
| Smiles: | Cc1cccc(c1)c1c(NC(C)(C)C)n2c(n1)sc(n2)N1CCN(CC1)C(Cc1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0333 |
| logD: | 5.0327 |
| logSw: | -4.714 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.727 |
| InChI Key: | TXUKTZJOUKSGKO-UHFFFAOYSA-N |