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Mebrofenin

CAT: 0931-T8364-06Size: 200 mgDry Ice: NoHazardous: No
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CAT#:0931-T8364-06Size:200 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
78266-06-5
Target
Others
Related Pathways
Others
Purity
0.9988
Bioactivity
Mebrofenin (SQ 26962) is available as a ready to use the kit for radio-labeling with Tc-99m.Technetium Tc 99m Mebrofenin is a diagnostic radiopharmaceutical composed of diisopropyl-iminodiacetic acid (DISIDA) attached to a technetium-99m ion.
Smiles
Cc1cc(C)c(NC(=O)CN(CC(O)=O)CC(O)=O)c(C)c1Br
Molecular Formula
C15H19BrN2O5
Molecular Weight
387.23
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Mebrofenin

Mebrofenin is an amino acid amide.

CAS Number78266-06-5
PubChem CID54158
IUPAC Name2-[[2-(3-bromo-2,4,6-trimethylanilino)-2-oxoethyl]-(carboxymethyl)amino]acetic acid
Molecular FormulaC15H19BrN2O5
Molecular Weight387.23
XLogP-0.1
Topological Polar Surface Area107
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Heavy Atom Count23
Formal Charge0
Complexity443
SMILES
CC1=CC(=C(C(=C1NC(=O)CN(CC(=O)O)CC(=O)O)C)Br)C
InChI
InChI=1S/C15H19BrN2O5/c1-8-4-9(2)15(10(3)14(8)16)17-11(19)5-18(6-12(20)21)7-13(22)23/h4H,5-7H2,1-3H3,(H,17,19)(H,20,21)(H,22,23)
InChIKey
MHPZZZZLAQGTHT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Mebrofenin
CAS: 78266-06-5
CID: 54158
Formula: C15H19BrN2O5
MW: 387.23
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight387.23
XLogP3-0.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Exact Mass386.04773
Monoisotopic Mass386.04773
Topological Polar Surface Area107 Ų
Heavy Atom Count23
Formal Charge0
Complexity443
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
AR-M03536-01Mebrofenin
HY-B1684RMebrofenin (Standard)
CS-O-54910Mebrofenin N-Oxide
CS-O-63480N-Nitroso Mebrofenin

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