5L0

1-[1-(imidazo[1,2-a]pyridin-5-yl)-7-(morpholin-4-yl)indolizin-3-yl]ethanone

Created:2015-10-15
Last modified:  2015-10-28

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Chemical Details

Formal Charge0
Atom Count47
Chiral Atom Count0
Bond Count51
Aromatic Bond Count20
2D diagram of 5L0

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Chemical Component Summary

Name1-[1-(imidazo[1,2-a]pyridin-5-yl)-7-(morpholin-4-yl)indolizin-3-yl]ethanone
Systematic Name (OpenEye OEToolkits)1-(1-imidazo[1,2-a]pyridin-5-yl-7-morpholin-4-yl-indolizin-3-yl)ethanone
FormulaC21 H20 N4 O2
Molecular Weight360.409
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01C1COCCN1c2ccn3c(c2)c(cc3C(=O)C)c5n4ccnc4ccc5
SMILESCACTVS3.385CC(=O)c1cc(c2cccc3nccn23)c4cc(ccn14)N5CCOCC5
SMILESOpenEye OEToolkits1.9.2CC(=O)c1cc(c2n1ccc(c2)N3CCOCC3)c4cccc5n4ccn5
Canonical SMILESCACTVS3.385 CC(=O)c1cc(c2cccc3nccn23)c4cc(ccn14)N5CCOCC5
Canonical SMILESOpenEye OEToolkits1.9.2 CC(=O)c1cc(c2n1ccc(c2)N3CCOCC3)c4cccc5n4ccn5
InChIInChI1.03 InChI=1S/C21H20N4O2/c1-15(26)19-14-17(18-3-2-4-21-22-6-8-25(18)21)20-13-16(5-7-24(19)20)23-9-11-27-12-10-23/h2-8,13-14H,9-12H2,1H3
InChIKeyInChI1.03 LBUBPCSKFDKKFO-UHFFFAOYSA-N

Related Resource References

Resource NameReference
Pharos CHEMBL3740819
PubChem 127038798
ChEMBL CHEMBL3740819