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MK8245

MK8245 structure

CAS No:
1030612-90-8
Formula:
C17H16BrFN6O4
Chemical Name:
MK8245
Synonyms:
5-[3-[4-(2-Bromo-5-fluorophenoxy)-1-piperidinyl]-5-isoxazolyl]-2H-tetrazole-2-acetic acid;2-(5-(3-(4-(2-broMo-5-fluorophenoxy)piperidin-1-yl)isoxazol-5-yl)-2H-tetrazol-2-yl)acetic acid
Categories:
Biochemical Engineering > Inhibitors

Description

MK-8245 is a liver-targeting inhibitor of stearoyl-CoA desaturase (SCD) with IC50 of 1 nM for human SCD1 and 3 nM for both rat SCD1 and mouse SCD1, with anti-diabetic and anti-dyslipidemic efficacy.IC50 value: 1 nM (hSCD1) [1]Target: SCD1in vitro: MK-8245, a phenoxy piperidine isoxazole derivative, has been identified as a potent and liver-specific SCD inhibitor. It contains a tetrazole acetic acid moiety, which is the key molecule for OATPs recognition and liver-targeting. MK-8245 displ

MK-8245 has been used in trials studying the treatment of Type 2 Diabetes Mellitus.

MK8245 Basic Attributes

Molecular Weight：

467.2491432

Exact Mass：

466.040039

UNII：

537E7QE8LX

DSSTox ID：

DTXSID80145625

Characteristics

PSA：

119

XLogP3：

3.4

Density：

1.82

Boiling Point：

698.3±65.0 °C(Predicted)

Flash Point：

376.1±34.3 °C

Refractive Index：

1.737

Safety Information

Packing level：

Ⅲ

Transport codes：

3077

hazard class code：

Drug Information

MeSH Entry Terms：

(5-(3-(4-(2-bromo-5-fluorophenoxy)piperidin-1-yl)isoxazol-5-yl)-2H-tetrazol-2-yl)acetic acid

Computed Properties

Molecular Weight:467.2
XLogP3:3.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:6
Exact Mass:466.04004
Monoisotopic Mass:466.04004
Topological Polar Surface Area:119
Heavy Atom Count:29
Complexity:572
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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