
 CHEMBL2349588

 70 73  0  0  0  0  0  0  0  0999 V2000
    2.6209   -1.9067    0.1954 C   0  0  0  0  0
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    5.5453    6.3113   -0.1663 H   0  0  0  0  0
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  1 36  1  0  0  0
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M  END

>  <Chemical Name>
CHEMBL2349588

>  <PubChem CID>
16737126

>  <Formula>
C29H35N3O3

>  <Molecular Weight>
473.617000

>  <IUPAC Name>
1-(3,3-diphenylpropyl)-3-[3-(hydroxymethyl)phenyl]-1-(2-morpholin-4-ylethyl)urea

>  <XlogP>
3.7

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
4

>  <Canonical SMILES>
C1COCCN1CCN(CCC(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NC4=CC=CC(=C4)CO

>  <Isomeric SMILES>
C1COCCN1CCN(CCC(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NC4=CC=CC(=C4)CO

>  <InChI Std. ID>
InChI=1S/C29H35N3O3/c33-23-24-8-7-13-27(22-24)30-29(34)32(17-16-31-18-20-35-21-19-31)15-14-28(25-9-3-1-4-10-25)26-11-5-2-6-12-26/h1-13,22,28,33H,14-21,23H2,(H,30,34)

>  <InChI Key>
APEYDQTXOQBNAB-UHFFFAOYSA-N

