2-{[5-(tert-butylamino)-6-(3-fluorophenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl](methyl)amino}-1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)ethan-1-one
Chemical Structure Depiction of
2-{[5-(tert-butylamino)-6-(3-fluorophenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl](methyl)amino}-1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)ethan-1-one
2-{[5-(tert-butylamino)-6-(3-fluorophenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl](methyl)amino}-1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)ethan-1-one
Compound characteristics
| Compound ID: | F449-3971 |
| Compound Name: | 2-{[5-(tert-butylamino)-6-(3-fluorophenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl](methyl)amino}-1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)ethan-1-one |
| Molecular Weight: | 502.61 |
| Molecular Formula: | C24 H31 F N6 O3 S |
| Smiles: | CC(C)(C)Nc1c(c2cccc(c2)F)nc2n1nc(N(C)CC(N1CCC3(CC1)OCCO3)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 3.2391 |
| logD: | 3.2391 |
| logSw: | -3.4776 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.111 |
| InChI Key: | VMPXUBRBRAGFNG-UHFFFAOYSA-N |