
 CHEMBL3633658

 67 70  0  0  0  0  0  0  0  0999 V2000
    2.5751    1.8017    2.5401 C   0  0  0  0  0
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    5.3639   11.0327    1.2635 C   0  0  0  0  0
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    1.0757    5.4901    1.1200 H   0  0  0  0  0
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    5.0856   11.5265    2.1924 H   0  0  0  0  0
    4.9040    9.0793    2.0143 H   0  0  0  0  0
  1  2  1  0  0  0
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M  END

>  <Chemical Name>
CHEMBL3633658

>  <PubChem CID>
122195448

>  <Formula>
C27H32N4O4

>  <Molecular Weight>
476.577000

>  <IUPAC Name>
N,N-dimethyl-2-[3-[2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetyl]-2-phenyl-1H-indol-5-yl]acetamide

>  <XlogP>
2.0

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
5

>  <Canonical SMILES>
CN(C)C(=O)CC1=CC2=C(C=C1)NC(=C2C(=O)CN(C)CC(=O)N3CCOCC3)C4=CC=CC=C4

>  <Isomeric SMILES>
CN(C)C(=O)CC1=CC2=C(C=C1)NC(=C2C(=O)CN(C)CC(=O)N3CCOCC3)C4=CC=CC=C4

>  <InChI Std. ID>
InChI=1S/C27H32N4O4/c1-29(2)24(33)16-19-9-10-22-21(15-19)26(27(28-22)20-7-5-4-6-8-20)23(32)17-30(3)18-25(34)31-11-13-35-14-12-31/h4-10,15,28H,11-14,16-18H2,1-3H3

>  <InChI Key>
LWBVBNWVKSYTRN-UHFFFAOYSA-N

