MK-0249

CAT: 0127-BUP08587-02Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0127-BUP08587-02Size:10 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

862309-06-6

Synonyms

MK 0249, MK0249

Purity

=98%

Smiles

Cc1nc2cccc(c2c(=O)n1-c1ccc(OCCCN2CCCC2)cc1)C(F)(F)F

Chemical Information

Mk-0249

MK0249 has been used in trials studying the treatment of Hypopnea Syndrome, Alzheimer's Disease, Paranoid Schizophrenia, Sleep Apnea, Obstructive, and Excessive Daytime Sleepiness, among others.

CAS Number	862309-06-6
PubChem CID	11697697
IUPAC Name	2-methyl-3-[4-(3-pyrrolidin-1-ylpropoxy)phenyl]-5-(trifluoromethyl)quinazolin-4-one
Molecular Formula	C23H24F3N3O2
Molecular Weight	431.4
XLogP	4.2
Topological Polar Surface Area	45.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	6
Heavy Atom Count	31
Formal Charge	0
Complexity	655

SMILES

CC1=NC2=CC=CC(=C2C(=O)N1C3=CC=C(C=C3)OCCCN4CCCC4)C(F)(F)F

InChI

InChI=1S/C23H24F3N3O2/c1-16-27-20-7-4-6-19(23(24,25)26)21(20)22(30)29(16)17-8-10-18(11-9-17)31-15-5-14-28-12-2-3-13-28/h4,6-11H,2-3,5,12-15H2,1H3

InChIKey

DDDZBLNULGDPGA-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 862309-06-6

CID: 11697697

Formula: C23H24F3N3O2

MW: 431.4

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	431.4
XLogP3	4.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	6
Exact Mass	431.18206150
Monoisotopic Mass	431.18206150
Topological Polar Surface Area	45.1 Å²
Heavy Atom Count	31
Formal Charge	0
Complexity	655
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Related Products

Catalog	Name
BUP01628-01	NT-0249
BUP05742-01	MK-7622
OR1005628-01	MK-5172
BUP23727-01	MK-0343
BUP24189-01	MK-8527
BUP20597-01	MK-5046
BUP01229-01	MK-6186
BUP12516-01	MK-3903
BUP02670-01	MK-0686
BUP09879-01	MK 1903

Alternative Products

Catalog	Name
GTR19205393-01	MK-0249
T12054L-01	MK-0249 FA
M33026-01	MK-0249 B
HY-161297	NT-0249
HY-161297A-01	NT-0249 (free base)
T210268-01	NT-0249 free base
324068-01	MK
167912	Midkine (MK, MK1, MK-1, MK 1) discontinued
MBS131426	MK-4101 (MK 4101; MK4101)
MBS131418	Doravirine (MK-1439; MK1439; MK 1439)

MK-0249

Chemical Information

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