2-{4-[5-(tert-butylamino)-6-(4-fluorophenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl}-1-(pyrrolidin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-{4-[5-(tert-butylamino)-6-(4-fluorophenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl}-1-(pyrrolidin-1-yl)ethan-1-one
2-{4-[5-(tert-butylamino)-6-(4-fluorophenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl}-1-(pyrrolidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | L532-1952 |
| Compound Name: | 2-{4-[5-(tert-butylamino)-6-(4-fluorophenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl}-1-(pyrrolidin-1-yl)ethan-1-one |
| Molecular Weight: | 485.63 |
| Molecular Formula: | C24 H32 F N7 O S |
| Smiles: | CC(C)(C)Nc1c(c2ccc(cc2)F)nc2n1nc(N1CCN(CC1)CC(N1CCCC1)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 3.6335 |
| logD: | 3.5715 |
| logSw: | -3.7661 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.079 |
| InChI Key: | PINSCSFAEQKMSJ-UHFFFAOYSA-N |