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MK-4256

CAT: 0013-GTR19204490-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19204490-03Size:100 mg
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Description
MK-4256 is a potent and selective somatostatin receptor subtype 3 (SSTR3) antagonist, demonstrating high affinity in binding assays. This small molecule is a valuable research tool for investigating SSTR3 function in metabolic and neurological studies, applicable in both in vitro and in vivo experimental models.
CAS Number
1104599-69-0
Field of Research
Pharmacology & Drug Discovery
Smiles
Cc1nc (no1) [C@@]1 (N[C@H] (Cc2c1[nH]c1ccccc21) c1ncc ([nH]1) -c1ccc (F) cc1) c1cnn (C) c1
Molecular Formula
C27H23FN8O
Molecular Weight
494.52
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

MK-4256

a somatostatin receptor 3 antagonist; structure in first source

CAS Number1104599-69-0
PubChem CID56927659
IUPAC Name3-[(1R,3R)-3-[5-(4-fluorophenyl)-1H-imidazol-2-yl]-1-(1-methylpyrazol-4-yl)-2,3,4,9-tetrahydropyrido[3,4-b]indol-1-yl]-5-methyl-1,2,4-oxadiazole
Molecular FormulaC27H23FN8O
Molecular Weight494.5
XLogP3.1
Topological Polar Surface Area113
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Heavy Atom Count37
Formal Charge0
Complexity815
SMILES
CC1=NC(=NO1)[C@]2(C3=C(C[C@@H](N2)C4=NC=C(N4)C5=CC=C(C=C5)F)C6=CC=CC=C6N3)C7=CN(N=C7)C
InChI
InChI=1S/C27H23FN8O/c1-15-31-26(35-37-15)27(17-12-30-36(2)14-17)24-20(19-5-3-4-6-21(19)32-24)11-22(34-27)25-29-13-23(33-25)16-7-9-18(28)10-8-16/h3-10,12-14,22,32,34H,11H2,1-2H3,(H,29,33)/t22-,27-/m1/s1
InChIKey
NTIFDLOQPKMIJK-AJTFRIOCSA-N
Chemical Structure
2D Structure
2D structure of MK-4256
CAS: 1104599-69-0
CID: 56927659
Formula: C27H23FN8O
MW: 494.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight494.5
XLogP33.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Exact Mass494.19788555
Monoisotopic Mass494.19788555
Topological Polar Surface Area113 Ų
Heavy Atom Count37
Formal Charge0
Complexity815
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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