
 MK-0489

 86 90  0  0  0  0  0  0  0  0999 V2000
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    8.1264    1.3182    2.1980 C   0  0  0  0  0
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   10.2637    0.3786    1.2321 C   0  0  0  0  0
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    0.6800    3.7654   -3.4629 H   0  0  0  0  0
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M  END

>  <Chemical Name>
MK-0489

>  <PubChem CID>
11753695

>  <Formula>
C34H44ClF2N3O2

>  <Molecular Weight>
600.192000

>  <IUPAC Name>
N-[2-[(1R)-1'-[(3S,4R)-1-tert-butyl-4-(2,4-difluorophenyl)pyrrolidine-3-carbonyl]-5-chloro-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]propan-2-yl]acetamide

>  <XlogP>
5.8

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
5

>  <Canonical SMILES>
CC1=C(C=C2C(=C1)C(CC23CCN(CC3)C(=O)C4CN(CC4C5=C(C=C(C=C5)F)F)C(C)(C)C)C(C)(C)NC(=O)C)Cl

>  <Isomeric SMILES>
CC1=C(C=C2C(=C1)[C@@H](CC23CCN(CC3)C(=O)[C@@H]4CN(C[C@H]4C5=C(C=C(C=C5)F)F)C(C)(C)C)C(C)(C)NC(=O)C)Cl

>  <InChI Std. ID>
InChI=1S/C34H44ClF2N3O2/c1-20-14-24-27(16-29(20)35)34(17-28(24)33(6,7)38-21(2)41)10-12-39(13-11-34)31(42)26-19-40(32(3,4)5)18-25(26)23-9-8-22(36)15-30(23)37/h8-9,14-16,25-26,28H,10-13,17-19H2,1-7H3,(H,38,41)/t25-,26+,28+/m0/s1

>  <InChI Key>
KMNARKQYUZICHM-ZRRKCSAHSA-N

