
 CID 44309234

 84 89  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
CID 44309234

>  <PubChem CID>
44309234

>  <Formula>
C35H40N6O3

>  <Molecular Weight>
592.744000

>  <IUPAC Name>
2-[3-[(4R)-2,5-dioxo-1-[(2R)-1-oxo-3-(4-phenylphenyl)-1-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylpropan-2-yl]imidazolidin-4-yl]propyl]guanidine

>  <XlogP>
4.3

>  <Hydrogen Bond Donors>
3

>  <Hydrogen Bond Acceptors>
4

>  <Canonical SMILES>
C1CC2(CCN(CC2)C(=O)C(CC3=CC=C(C=C3)C4=CC=CC=C4)N5C(=O)C(NC5=O)CCCN=C(N)N)C6=CC=CC=C61

>  <Isomeric SMILES>
C1CC2(CCN(CC2)C(=O)[C@@H](CC3=CC=C(C=C3)C4=CC=CC=C4)N5C(=O)[C@H](NC5=O)CCCN=C(N)N)C6=CC=CC=C61

>  <InChI Std. ID>
InChI=1S/C35H40N6O3/c36-33(37)38-20-6-11-29-31(42)41(34(44)39-29)30(23-24-12-14-26(15-13-24)25-7-2-1-3-8-25)32(43)40-21-18-35(19-22-40)17-16-27-9-4-5-10-28(27)35/h1-5,7-10,12-15,29-30H,6,11,16-23H2,(H,39,44)(H4,36,37,38)/t29-,30-/m1/s1

>  <InChI Key>
BPPWHXFCRJIMAB-LOYHVIPDSA-N

