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ER-000444793

CAT: 0607-BA7992-5Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0607-BA7992-5Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
792957-74-5
Form
A solid
Molecular Formula
C23H18N2O2
Molecular Weight
354.40
Shipping Conditions
Blue ice
Storage Conditions
-20°C.

Chemical Information

N-(2-benzylphenyl)-2-oxo-1,2-dihydroquinoline-4-carboxamide
CAS Number792957-74-5
PubChem CID2547533
IUPAC NameN-(2-benzylphenyl)-2-oxo-1H-quinoline-4-carboxamide
Molecular FormulaC23H18N2O2
Molecular Weight354.4
XLogP3.8
Topological Polar Surface Area58.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Heavy Atom Count27
Formal Charge0
Complexity579
SMILES
C1=CC=C(C=C1)CC2=CC=CC=C2NC(=O)C3=CC(=O)NC4=CC=CC=C43
InChI
InChI=1S/C23H18N2O2/c26-22-15-19(18-11-5-7-13-21(18)24-22)23(27)25-20-12-6-4-10-17(20)14-16-8-2-1-3-9-16/h1-13,15H,14H2,(H,24,26)(H,25,27)
InChIKey
OIZPRRGJIHYZAY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(2-benzylphenyl)-2-oxo-1,2-dihydroquinoline-4-carboxamide
CAS: 792957-74-5
CID: 2547533
Formula: C23H18N2O2
MW: 354.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight354.4
XLogP33.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass354.136827821
Monoisotopic Mass354.136827821
Topological Polar Surface Area58.2 Ų
Heavy Atom Count27
Formal Charge0
Complexity579
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