2-(4-fluorophenoxy)-1-{3-[(2-methoxyethyl)amino]spiro[1,4-diazabicyclo[3.2.1]oct-3-ene-2,4'-piperidin]-1'-yl}ethan-1-one
Chemical Structure Depiction of
2-(4-fluorophenoxy)-1-{3-[(2-methoxyethyl)amino]spiro[1,4-diazabicyclo[3.2.1]oct-3-ene-2,4'-piperidin]-1'-yl}ethan-1-one
2-(4-fluorophenoxy)-1-{3-[(2-methoxyethyl)amino]spiro[1,4-diazabicyclo[3.2.1]oct-3-ene-2,4'-piperidin]-1'-yl}ethan-1-one
Compound characteristics
| Compound ID: | S236-0083 |
| Compound Name: | 2-(4-fluorophenoxy)-1-{3-[(2-methoxyethyl)amino]spiro[1,4-diazabicyclo[3.2.1]oct-3-ene-2,4'-piperidin]-1'-yl}ethan-1-one |
| Molecular Weight: | 404.48 |
| Molecular Formula: | C21 H29 F N4 O3 |
| Smiles: | COCCNC1C2(CCN(CC2)C(COc2ccc(cc2)F)=O)N2CCC(C2)N=1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1295 |
| logD: | -0.1125 |
| logSw: | -1.9178 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.074 |
| InChI Key: | LHJAPKATYLDXJX-UHFFFAOYSA-N |