1-(azepan-1-yl)-2-{[5-(tert-butylamino)-6-(4-fluorophenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl](methyl)amino}ethan-1-one
Chemical Structure Depiction of
1-(azepan-1-yl)-2-{[5-(tert-butylamino)-6-(4-fluorophenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl](methyl)amino}ethan-1-one
1-(azepan-1-yl)-2-{[5-(tert-butylamino)-6-(4-fluorophenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl](methyl)amino}ethan-1-one
Compound characteristics
| Compound ID: | F449-2961 |
| Compound Name: | 1-(azepan-1-yl)-2-{[5-(tert-butylamino)-6-(4-fluorophenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl](methyl)amino}ethan-1-one |
| Molecular Weight: | 458.6 |
| Molecular Formula: | C23 H31 F N6 O S |
| Smiles: | CC(C)(C)Nc1c(c2ccc(cc2)F)nc2n1nc(N(C)CC(N1CCCCCC1)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 4.4923 |
| logD: | 4.4923 |
| logSw: | -4.0842 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.006 |
| InChI Key: | XICGLDAMVUIZFY-UHFFFAOYSA-N |