
 CHEMBL3908495

 72 74  0  0  0  0  0  0  0  0999 V2000
    1.3637    2.2595   -0.0264 C   0  0  0  0  0
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M  END

>  <Chemical Name>
CHEMBL3908495

>  <PubChem CID>
89799862

>  <Formula>
C28H34F5N3O2

>  <Molecular Weight>
539.591000

>  <IUPAC Name>
(3R,4S)-N-[3-(difluoromethyl)-5-(trifluoromethyl)phenyl]-1-(2,6-dimethylphenyl)-4-methyl-3-[[methyl(2-methylpropyl)amino]methyl]-5-oxopyrrolidine-3-carboxamide

>  <XlogP>
5.8

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
8

>  <Canonical SMILES>
CC1C(=O)N(CC1(CN(C)CC(C)C)C(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)F)C3=C(C=CC=C3C)C

>  <Isomeric SMILES>
C[C@@H]1C(=O)N(C[C@@]1(CN(C)CC(C)C)C(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)F)C3=C(C=CC=C3C)C

>  <InChI Std. ID>
InChI=1S/C28H34F5N3O2/c1-16(2)13-35(6)14-27(15-36(25(37)19(27)5)23-17(3)8-7-9-18(23)4)26(38)34-22-11-20(24(29)30)10-21(12-22)28(31,32)33/h7-12,16,19,24H,13-15H2,1-6H3,(H,34,38)/t19-,27-/m1/s1

>  <InChI Key>
LAZGCGKIBDFSLJ-XHCCPWGMSA-N

