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NCGC00244536

CAT: 0607-BA4782-5Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0607-BA4782-5Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2003260-55-5
Form
A solid
Molecular Formula
C25H22N2O2
Molecular Weight
382.45
Shipping Conditions
Blue ice
Storage Conditions
-20°C.

Chemical Information

3-(8-Hydroxyquinolin-6-YL)-N-(3-phenylpropyl)benzamide
CAS Number2003260-55-5
PubChem CID127030711
IUPAC Name3-(8-hydroxyquinolin-6-yl)-N-(3-phenylpropyl)benzamide
Molecular FormulaC25H22N2O2
Molecular Weight382.5
XLogP5.1
Topological Polar Surface Area62.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Heavy Atom Count29
Formal Charge0
Complexity519
SMILES
C1=CC=C(C=C1)CCCNC(=O)C2=CC=CC(=C2)C3=CC(=C4C(=C3)C=CC=N4)O
InChI
InChI=1S/C25H22N2O2/c28-23-17-22(16-20-12-6-13-26-24(20)23)19-10-4-11-21(15-19)25(29)27-14-5-9-18-7-2-1-3-8-18/h1-4,6-8,10-13,15-17,28H,5,9,14H2,(H,27,29)
InChIKey
NYKBXXGHEMXSBB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-(8-Hydroxyquinolin-6-YL)-N-(3-phenylpropyl)benzamide
CAS: 2003260-55-5
CID: 127030711
Formula: C25H22N2O2
MW: 382.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight382.5
XLogP35.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Exact Mass382.168127949
Monoisotopic Mass382.168127949
Topological Polar Surface Area62.2 Ų
Heavy Atom Count29
Formal Charge0
Complexity519
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

Alternative Products

CatalogName
B1956-5NCGC00244536
A13025-50NCGC00244536 50mg
A13025-100NCGC00244536 100mg
A13025-10NCGC00244536 10mg
A13025-5NCGC00244536 5mg
A13025-25NCGC00244536 25mg
A13025-1NCGC00244536 1mg
A13025-10mM-DNCGC00244536 10mM * 1mL in DMSO

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