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IC87361

CAT: 0931-T69286-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T69286-02Size:50 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
404011-02-5
Target
Others
Related Pathways
Others
Bioactivity
IC87361 is a potent and specific inhibitor of DNA-PK.
Smiles
O=C1C=2C(=CC(=CC2O)N3CCOCC3)OC(=C1)C4=CC=CC=C4
Molecular Formula
C19H17NO4
Molecular Weight
323.34
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

5-Hydroxy-7-morpholin-4-yl-2-phenyl-chromen-4-one
CAS Number404011-02-5
PubChem CID11688386
IUPAC Name5-hydroxy-7-morpholin-4-yl-2-phenylchromen-4-one
Molecular FormulaC19H17NO4
Molecular Weight323.3
XLogP2.2
Topological Polar Surface Area59
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count24
Formal Charge0
Complexity494
SMILES
C1COCCN1C2=CC(=C3C(=C2)OC(=CC3=O)C4=CC=CC=C4)O
InChI
InChI=1S/C19H17NO4/c21-15-10-14(20-6-8-23-9-7-20)11-18-19(15)16(22)12-17(24-18)13-4-2-1-3-5-13/h1-5,10-12,21H,6-9H2
InChIKey
QLCYMYHLQRGYAZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-Hydroxy-7-morpholin-4-yl-2-phenyl-chromen-4-one
CAS: 404011-02-5
CID: 11688386
Formula: C19H17NO4
MW: 323.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight323.3
XLogP32.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass323.11575802
Monoisotopic Mass323.11575802
Topological Polar Surface Area59 Ų
Heavy Atom Count24
Formal Charge0
Complexity494
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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