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(1R,2R) -MK-8189

CAT: 0127-BUP21045-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0127-BUP21045-01Size:5 mg
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CAS Number
1424378-99-3
Synonyms
(1R,2R) MK-8189 | (1R,2R) MK8189
Purity
=98%
Smiles
C(OC=1C=C(NCC2=NN=C(C)S2)N=C(C)N1)[C@H]3[C@@H](C3)C4=CC=C(C)C=N4

Chemical Information

2-methyl-6-[[(1R,2R)-2-(5-methyl-2-pyridinyl)cyclopropyl]methoxy]-N-[(5-methyl-1,3,4-thiadiazol-2-yl)methyl]pyrimidin-4-amine
CAS Number1424378-99-3
PubChem CID71532422
IUPAC Name2-methyl-6-[[(1R,2R)-2-(5-methyl-2-pyridinyl)cyclopropyl]methoxy]-N-[(5-methyl-1,3,4-thiadiazol-2-yl)methyl]pyrimidin-4-amine
Molecular FormulaC19H22N6OS
Molecular Weight382.5
XLogP3.1
Topological Polar Surface Area114
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count7
Heavy Atom Count27
Formal Charge0
Complexity485
SMILES
CC1=CN=C(C=C1)[C@@H]2C[C@H]2COC3=NC(=NC(=C3)NCC4=NN=C(S4)C)C
InChI
InChI=1S/C19H22N6OS/c1-11-4-5-16(20-8-11)15-6-14(15)10-26-18-7-17(22-12(2)23-18)21-9-19-25-24-13(3)27-19/h4-5,7-8,14-15H,6,9-10H2,1-3H3,(H,21,22,23)/t14-,15+/m0/s1
InChIKey
WQKPZDLZRFTMTI-LSDHHAIUSA-N
Chemical Structure
2D Structure
2D structure of 2-methyl-6-[[(1R,2R)-2-(5-methyl-2-pyridinyl)cyclopropyl]methoxy]-N-[(5-methyl-1,3,4-thiadiazol-2-yl)methyl]pyrimidin-4-amine
CAS: 1424378-99-3
CID: 71532422
Formula: C19H22N6OS
MW: 382.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight382.5
XLogP33.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count7
Exact Mass382.15758052
Monoisotopic Mass382.15758052
Topological Polar Surface Area114 Ų
Heavy Atom Count27
Formal Charge0
Complexity485
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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Alternative Products

CatalogName
T73462L-01(1R,2R) -MK-8189
M4560-05Montelukast-d6, Sodium Salt (1-[1-[[[ (1R) -1-[3-[ (1E) -2- (7-Chloro-2-quinolinyl) ethenyl]phenyl]-3-[2- (1-hydroxy-1-methylethyl-d6) phenyl]propyl]thio]methyl]cyclopropaneacetic Acid Sodium Salt, MK-476-d6, Singulair)
MBS6057302-01Montelukast-d6, Sodium Salt (1-[1-[[[(1R)-1-[3-[(1E)-2-(7-Chloro-2-quinolinyl)ethenyl]phenyl]-3-[2-(1-hydroxy-1-methylethyl-d6)phenyl]propyl]thio]methyl]cyclopropaneacetic Acid Sodium Salt, MK-476-d6, Singulair)
GTR19212085-01MK-8189
HY-153093A(1R,2R) -Elpipodect
RM-B201409-01(1R,2R) -Bortezomib
TRC-B675705-5MG(1R,2R)-Bortezomib
TRC-D416090-1G(1R,2R)-(-)-Diaminocyclohexane
CS-O-57383Ticagrelor (1R,2R,3S,5R) 7- (1R,2R) -Isomer
CS-T-96439(1R,2R) -Bortezomib-d5

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