DK7

N-[(1S,2S)-1-[(3R,6R)-6-(cyclohexylmethoxy)morpholin-3-yl]-3-(3,5-difluorophenyl)-1-hydroxypropan-2-yl]acetamide


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Chemical Component Summary

NameN-[(1S,2S)-1-[(3R,6R)-6-(cyclohexylmethoxy)morpholin-3-yl]-3-(3,5-difluorophenyl)-1-hydroxypropan-2-yl]acetamide
Identifiers~{N}-[(1~{S},2~{S})-3-[3,5-bis(fluoranyl)phenyl]-1-[(3~{R},6~{R})-6-(cyclohexylmethoxy)morpholin-3-yl]-1-oxidanyl-propan-2-yl]ethanamide
FormulaC22 H32 F2 N2 O4
Molecular Weight426.497
TypeNON-POLYMER
Isomeric SMILESCC(=O)N[C@@H](Cc1cc(cc(c1)F)F)[C@@H]([C@H]2CO[C@H](CN2)OCC3CCCCC3)O
InChIInChI=1S/C22H32F2N2O4/c1-14(27)26-19(9-16-7-17(23)10-18(24)8-16)22(28)20-13-30-21(11-25-20)29-12-15-5-3-2-4-6-15/h7-8,10,15,19-22,25,28H,2-6,9,11-13H2,1H3,(H,26,27)/t19-,20+,21+,22-/m0/s1
InChIKeyXQHQHHREHKYCIG-CBPXPLCBSA-N

Chemical Details

Formal Charge0
Atom Count62
Chiral Atom Count4
Bond Count64
Aromatic Bond Count6

Related Resource References

Resource NameReference
PubChem 131800993
ChEMBL CHEMBL4116001