
 SCHEMBL9998176

 64 68  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
SCHEMBL9998176

>  <PubChem CID>
68003506

>  <Formula>
C24H29F3N6O2

>  <Molecular Weight>
490.531000

>  <IUPAC Name>
N-[1-[4-(2-oxopyrrolidin-1-yl)cyclohexyl]azetidin-3-yl]-2-[[6-(trifluoromethyl)quinazolin-4-yl]amino]acetamide

>  <XlogP>
2.9

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
9

>  <Canonical SMILES>
C1CC(=O)N(C1)C2CCC(CC2)N3CC(C3)NC(=O)CNC4=NC=NC5=C4C=C(C=C5)C(F)(F)F

>  <Isomeric SMILES>
C1CC(=O)N(C1)C2CCC(CC2)N3CC(C3)NC(=O)CNC4=NC=NC5=C4C=C(C=C5)C(F)(F)F

>  <InChI Std. ID>
InChI=1S/C24H29F3N6O2/c25-24(26,27)15-3-8-20-19(10-15)23(30-14-29-20)28-11-21(34)31-16-12-32(13-16)17-4-6-18(7-5-17)33-9-1-2-22(33)35/h3,8,10,14,16-18H,1-2,4-7,9,11-13H2,(H,31,34)(H,28,29,30)

>  <InChI Key>
RDGFHBPSDVQZEM-UHFFFAOYSA-N

