PCSK9-IN-11

CAT: 0607-BA8066-25Size: 25 mgDry Ice: NoHazardous: No

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CAT#:0607-BA8066-25Size:25 mg

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

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CAS Number

2882035-56-3

Form

A solid

Molecular Formula

C16H17ClFN5O3

Molecular Weight

381.79

Shipping Conditions

Blue ice

Storage Conditions

4°C, protect from light.

Chemical Information

Pcsk9-IN-11

CAS Number	2882035-56-3
PubChem CID	166527747
IUPAC Name	7-[(3-chloro-2-fluorophenyl)methyl]-8-(2-hydroxyethylamino)-1,3-dimethylpurine-2,6-dione
Molecular Formula	C16H17ClFN5O3
Molecular Weight	381.79
XLogP	1.5
Topological Polar Surface Area	90.7
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	5
Heavy Atom Count	26
Formal Charge	0
Complexity	556

SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NCCO)CC3=C(C(=CC=C3)Cl)F

InChI

InChI=1S/C16H17ClFN5O3/c1-21-13-12(14(25)22(2)16(21)26)23(15(20-13)19-6-7-24)8-9-4-3-5-10(17)11(9)18/h3-5,24H,6-8H2,1-2H3,(H,19,20)

InChIKey

UVWKWCCDYSHPMZ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2882035-56-3

CID: 166527747

Formula: C16H17ClFN5O3

MW: 381.79

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	381.79
XLogP3	1.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	5
Exact Mass	381.1003953
Monoisotopic Mass	381.1003953
Topological Polar Surface Area	90.7 Å²
Heavy Atom Count	26
Formal Charge	0
Complexity	556
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

Catalog	Name
F1631-5	Anti-PCSK9 Antibody (Boehringer anti-PCSK9)
F1631-1	Anti-PCSK9 Antibody (Boehringer anti-PCSK9)
BA8062-5	PCSK9-IN-12
BA8064-10	PCSK9-IN-10
F1631-.1	Anti-PCSK9 Antibody (Boehringer anti-PCSK9)
F1631-50	Anti-PCSK9 Antibody (Boehringer anti-PCSK9)
BA8062-5.1	PCSK9-IN-12
BA8062-1	PCSK9-IN-12
BA8069-1	PCSK9-IN-13
BA8064-100	PCSK9-IN-10

Catalog	Name
BUP06574-01	PCSK9-IN-11
pro-2043	PCSK9
048564	PCSK9 (Boehringer PCSK9) discontinued
048566	PCSK9 (Schering patent PCSK9) discontinued
C00552-1mg	Anti-PCSK9 (Boehringer anti-PCSK9)
048565	PCSK9 (Merck patent PCSK9) discontinued
70R-19161	PCSK9 antibody
HY-155415	PCSK9-IN-20
HY-152221-01	PCSK9-IN-10
HY-N10702	PCSK9-IN-9