2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-1-[3-(4-fluorophenyl)-5-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
Chemical Structure Depiction of
2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-1-[3-(4-fluorophenyl)-5-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-1-[3-(4-fluorophenyl)-5-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
Compound characteristics
Compound ID: | V021-2664 |
Compound Name: | 2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-1-[3-(4-fluorophenyl)-5-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one |
Molecular Weight: | 426.49 |
Molecular Formula: | C23 H27 F N4 O3 |
Salt: | not_available |
Smiles: | Cn1cccc1C1CC(c2ccc(cc2)F)=NN1C(CN1CCC2(CC1)OCCO2)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.9336 |
logD: | 2.8709 |
logSw: | -3.1278 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 47.445 |
InChI Key: | QBOCLAYPHNWRRV-OAQYLSRUSA-N |