MK-0608

CAT: 0931-T16088-07Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0931-T16088-07Size:50 mg

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

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CAS Number

443642-29-3

Target

HCV Protease

Related Pathways

Proteases/Proteasome, Microbiology/Virology

Purity

0.9942

Bioactivity

MK-0608 is an orally bioavailable HCV replication inhibitor in vitro (EC50 = 0.3 μM and EC90=1.3 μM in the subgenomic-replicon assay) .

Smiles

C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1ccc2c(N)ncnc12

Molecular Formula

C12H16N4O4

Molecular Weight

280.28

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

7-Deaza-2'-C-methyladenosine

an antiviral agent

CAS Number	443642-29-3
PubChem CID	3011893
IUPAC Name	(2R,3R,4R,5R)-2-(4-aminopyrrolo[2,3-d]pyrimidin-7-yl)-5-(hydroxymethyl)-3-methyloxolane-3,4-diol
Molecular Formula	C12H16N4O4
Molecular Weight	280.28
XLogP	-1.2
Topological Polar Surface Area	127
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	2
Heavy Atom Count	20
Formal Charge	0
Complexity	373

SMILES

C[C@]1([C@@H]([C@H](O[C@H]1N2C=CC3=C(N=CN=C32)N)CO)O)O

InChI

InChI=1S/C12H16N4O4/c1-12(19)8(18)7(4-17)20-11(12)16-3-2-6-9(13)14-5-15-10(6)16/h2-3,5,7-8,11,17-19H,4H2,1H3,(H2,13,14,15)/t7-,8-,11-,12-/m1/s1

InChIKey

IRZRJANZDIOOIF-GAJNKVMBSA-N

Chemical Structure

2D Structure

CAS: 443642-29-3

CID: 3011893

Formula: C12H16N4O4

MW: 280.28

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	280.28
XLogP3	-1.2
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	2
Exact Mass	280.11715500
Monoisotopic Mass	280.11715500
Topological Polar Surface Area	127 Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	373
Isotope Atom Count	0
Defined Atom Stereocenter Count	4
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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BA1868-5	MK-0608
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286667	MINIPIC 0608 D Facility & Office Signs & Labels (Adhesive)
MBS131418	Doravirine (MK-1439; MK1439; MK 1439)
MBS131438	MK-4827 (Niraparib; MK 4827; MK4827)
456310-01	MK 677
MKB78162-01	MK-0674
A3615-10	MK-3207

MK-0608

Chemical Information

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