ethyl N-{4-[5-(tert-butylamino)-6-phenylimidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazine-1-carbonyl}-beta-alaninate
Chemical Structure Depiction of
ethyl N-{4-[5-(tert-butylamino)-6-phenylimidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazine-1-carbonyl}-beta-alaninate
ethyl N-{4-[5-(tert-butylamino)-6-phenylimidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazine-1-carbonyl}-beta-alaninate
Compound characteristics
| Compound ID: | L327-9466 |
| Compound Name: | ethyl N-{4-[5-(tert-butylamino)-6-phenylimidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazine-1-carbonyl}-beta-alaninate |
| Molecular Weight: | 499.63 |
| Molecular Formula: | C24 H33 N7 O3 S |
| Smiles: | CCOC(CCNC(N1CCN(CC1)c1nn2c(c(c3ccccc3)nc2s1)NC(C)(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7428 |
| logD: | 3.7426 |
| logSw: | -3.7744 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.651 |
| InChI Key: | UNGQGFFTUQNGEC-UHFFFAOYSA-N |