2-{[5-(tert-butylamino)-6-phenylimidazo[2,1-b][1,3,4]thiadiazol-2-yl](methyl)amino}-1-(4-ethylpiperazin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-{[5-(tert-butylamino)-6-phenylimidazo[2,1-b][1,3,4]thiadiazol-2-yl](methyl)amino}-1-(4-ethylpiperazin-1-yl)ethan-1-one
2-{[5-(tert-butylamino)-6-phenylimidazo[2,1-b][1,3,4]thiadiazol-2-yl](methyl)amino}-1-(4-ethylpiperazin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | F449-4630 |
| Compound Name: | 2-{[5-(tert-butylamino)-6-phenylimidazo[2,1-b][1,3,4]thiadiazol-2-yl](methyl)amino}-1-(4-ethylpiperazin-1-yl)ethan-1-one |
| Molecular Weight: | 455.62 |
| Molecular Formula: | C23 H33 N7 O S |
| Smiles: | CCN1CCN(CC1)C(CN(C)c1nn2c(c(c3ccccc3)nc2s1)NC(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0251 |
| logD: | 2.8489 |
| logSw: | -3.1378 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.211 |
| InChI Key: | NCPFUXMWPIQCFM-UHFFFAOYSA-N |