
 SCHEMBL3499551

 62 66  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
SCHEMBL3499551

>  <PubChem CID>
59335807

>  <Formula>
C30H24ClN3O4

>  <Molecular Weight>
525.989000

>  <IUPAC Name>
2-[[2-(4-chlorophenyl)imidazo[1,2-a]pyridine-6-carbonyl]amino]-3-(4-phenylmethoxyphenyl)propanoic acid

>  <XlogP>
6.4

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
5

>  <Canonical SMILES>
C1=CC=C(C=C1)COC2=CC=C(C=C2)CC(C(=O)O)NC(=O)C3=CN4C=C(N=C4C=C3)C5=CC=C(C=C5)Cl

>  <Isomeric SMILES>
C1=CC=C(C=C1)COC2=CC=C(C=C2)CC(C(=O)O)NC(=O)C3=CN4C=C(N=C4C=C3)C5=CC=C(C=C5)Cl

>  <InChI Std. ID>
InChI=1S/C30H24ClN3O4/c31-24-11-8-22(9-12-24)27-18-34-17-23(10-15-28(34)32-27)29(35)33-26(30(36)37)16-20-6-13-25(14-7-20)38-19-21-4-2-1-3-5-21/h1-15,17-18,26H,16,19H2,(H,33,35)(H,36,37)

>  <InChI Key>
RJKOUWKUQCNQLF-UHFFFAOYSA-N

