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N- (2-Morpholinophenyl) -2- (quinolin-8-yloxy) acetamide

CAT: 0127-OR1067507-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0127-OR1067507-01Size:50 mg
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CAS Number
796119-18-1
Purity
98%
Smiles
O=C(NC1=C(N2CCOCC2)C=CC=C1)COC3=C4N=CC=CC4=CC=C3

Chemical Information

N-(2-Morpholinophenyl)-2-(quinolin-8-yloxy)acetamide
CAS Number796119-18-1
PubChem CID4879545
IUPAC NameN-(2-morpholin-4-ylphenyl)-2-quinolin-8-yloxyacetamide
Molecular FormulaC21H21N3O3
Molecular Weight363.4
XLogP2.8
Topological Polar Surface Area63.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count27
Formal Charge0
Complexity483
SMILES
C1COCCN1C2=CC=CC=C2NC(=O)COC3=CC=CC4=C3N=CC=C4
InChI
InChI=1S/C21H21N3O3/c25-20(15-27-19-9-3-5-16-6-4-10-22-21(16)19)23-17-7-1-2-8-18(17)24-11-13-26-14-12-24/h1-10H,11-15H2,(H,23,25)
InChIKey
ZJRDHGFMVANNGO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(2-Morpholinophenyl)-2-(quinolin-8-yloxy)acetamide
CAS: 796119-18-1
CID: 4879545
Formula: C21H21N3O3
MW: 363.4
Interactive 3D Structure
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Computed Properties
PropertyValue
Molecular Weight363.4
XLogP32.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass363.15829154
Monoisotopic Mass363.15829154
Topological Polar Surface Area63.7 Ų
Heavy Atom Count27
Formal Charge0
Complexity483
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