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MK-251

CAT: 0931-T33430-03Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T33430-03Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
40396-83-6
Target
Others
Related Pathways
Others
Bioactivity
MK-251 is a potential bioactive agent. No further details yet.
Smiles
OCCS(O)(=O)=O.CC(C)(N)c1ccc(cc1)C(F)(F)C(F)(F)c1ccccc1
Molecular Formula
C19H23F4NO4S
Molecular Weight
437.45
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

MK 251

RN & NM refer to isethionate; structure

CAS Number40396-83-6
PubChem CID176160
IUPAC Name2-[4-(1,1,2,2-tetrafluoro-2-phenylethyl)phenyl]propan-2-amine
Molecular FormulaC17H17F4N
Molecular Weight311.32
XLogP4
Topological Polar Surface Area26
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count22
Formal Charge0
Complexity367
SMILES
CC(C)(C1=CC=C(C=C1)C(C(C2=CC=CC=C2)(F)F)(F)F)N
InChI
InChI=1S/C17H17F4N/c1-15(2,22)12-8-10-14(11-9-12)17(20,21)16(18,19)13-6-4-3-5-7-13/h3-11H,22H2,1-2H3
InChIKey
YTXBIQSEDPVQBC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of MK 251
CAS: 40396-83-6
CID: 176160
Formula: C17H17F4N
MW: 311.32
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight311.32
XLogP34
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass311.12971219
Monoisotopic Mass311.12971219
Topological Polar Surface Area26 Ų
Heavy Atom Count22
Formal Charge0
Complexity367
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