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NCGC00247743 10mg

CAT: 0628-A19499-10Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0628-A19499-10Size:10 mg
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CAS Number
1435192-04-3

Chemical Information

N-[6-(Dimethylamino)hexyl]-3-(8-hydroxyquinolin-6-yl)benzamide
CAS Number1435192-04-3
PubChem CID89564218
IUPAC NameN-[6-(dimethylamino)hexyl]-3-(8-hydroxyquinolin-6-yl)benzamide
Molecular FormulaC24H29N3O2
Molecular Weight391.5
XLogP4.2
Topological Polar Surface Area65.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count9
Heavy Atom Count29
Formal Charge0
Complexity499
SMILES
CN(C)CCCCCCNC(=O)C1=CC=CC(=C1)C2=CC(=C3C(=C2)C=CC=N3)O
InChI
InChI=1S/C24H29N3O2/c1-27(2)14-6-4-3-5-12-26-24(29)20-10-7-9-18(15-20)21-16-19-11-8-13-25-23(19)22(28)17-21/h7-11,13,15-17,28H,3-6,12,14H2,1-2H3,(H,26,29)
InChIKey
RAUALYDCIUPMKI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-[6-(Dimethylamino)hexyl]-3-(8-hydroxyquinolin-6-yl)benzamide
CAS: 1435192-04-3
CID: 89564218
Formula: C24H29N3O2
MW: 391.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight391.5
XLogP34.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count9
Exact Mass391.22597718
Monoisotopic Mass391.22597718
Topological Polar Surface Area65.5 Ų
Heavy Atom Count29
Formal Charge0
Complexity499
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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