
 SCHEMBL15969131

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M  END

>  <Chemical Name>
SCHEMBL15969131

>  <PubChem CID>
77461009

>  <Formula>
C23H24F3N3O2

>  <Molecular Weight>
431.459000

>  <IUPAC Name>
(6R)-1-(2,6-dimethylpyridin-4-yl)-3-[3-methoxy-4-(trifluoromethyl)phenyl]-6-methyl-5,6,8,9-tetrahydroimidazo[1,5-d][1,4]oxazepine

>  <XlogP>
4.2

>  <Hydrogen Bond Donors>
0

>  <Hydrogen Bond Acceptors>
7

>  <Canonical SMILES>
CC1CN2C(=C(N=C2C3=CC(=C(C=C3)C(F)(F)F)OC)C4=CC(=NC(=C4)C)C)CCO1

>  <Isomeric SMILES>
C[C@@H]1CN2C(=C(N=C2C3=CC(=C(C=C3)C(F)(F)F)OC)C4=CC(=NC(=C4)C)C)CCO1

>  <InChI Std. ID>
InChI=1S/C23H24F3N3O2/c1-13-9-17(10-14(2)27-13)21-19-7-8-31-15(3)12-29(19)22(28-21)16-5-6-18(23(24,25)26)20(11-16)30-4/h5-6,9-11,15H,7-8,12H2,1-4H3/t15-/m1/s1

>  <InChI Key>
APMWPHBIJMOMCH-OAHLLOKOSA-N

