
 CHEMBL64383

 58 61  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
CHEMBL64383

>  <PubChem CID>
15650875

>  <Formula>
C22H30N2O4

>  <Molecular Weight>
386.492000

>  <IUPAC Name>
7-[2-(azepan-1-yl)ethoxy]-8-methyl-2-morpholin-4-ylchromen-4-one

>  <XlogP>
3.1

>  <Hydrogen Bond Donors>
0

>  <Hydrogen Bond Acceptors>
6

>  <Canonical SMILES>
CC1=C(C=CC2=C1OC(=CC2=O)N3CCOCC3)OCCN4CCCCCC4

>  <Isomeric SMILES>
CC1=C(C=CC2=C1OC(=CC2=O)N3CCOCC3)OCCN4CCCCCC4

>  <InChI Std. ID>
InChI=1S/C22H30N2O4/c1-17-20(27-15-10-23-8-4-2-3-5-9-23)7-6-18-19(25)16-21(28-22(17)18)24-11-13-26-14-12-24/h6-7,16H,2-5,8-15H2,1H3

>  <InChI Key>
BDASRWPCTUFLKI-UHFFFAOYSA-N

