PPACK

CAT: 1106-BML-PI117-0025Size: 25 mgDry Ice: NoHazardous: No

1 / 1

CAT#:1106-BML-PI117-0025Size:25 mg

Selected

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

Quick Request Actions

CAS Number

71142-71-7

Product Name Alternative

D-Phe-Pro-Arg-CMK

Certification

RUO

Sequence

D-Phe-Pro-Arg-chloromethylketone

Stability

As indicated on product label or CoA when stored as recommended. Stable for at least 1 year after receipt when stored at -20°C. Stock solutions are stable for up to 3 months at -20°C.

Purity

≥90% (HPLC)

Solubility

Soluble in water.

Molecular Formula

C 21 H 31 ClN 6 O 3

Molecular Weight

451.0

Shipping Conditions

Blue Ice

Storage Conditions

-20°C

Notes

Note: Product is not sterile.

Appearance

White to off-white solid.

Chemical Information

Ppack

CAS Number	71142-71-7
PubChem CID	5311176
IUPAC Name	(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]-N-[(3S)-1-chloro-6-(diaminomethylideneamino)-2-oxohexan-3-yl]pyrrolidine-2-carboxamide
Molecular Formula	C21H31ClN6O3
Molecular Weight	451.0
XLogP	0.2
Topological Polar Surface Area	157
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	11
Heavy Atom Count	31
Formal Charge	0
Complexity	649

SMILES

C1C[C@H](N(C1)C(=O)[C@@H](CC2=CC=CC=C2)N)C(=O)N[C@@H](CCCN=C(N)N)C(=O)CCl

InChI

InChI=1S/C21H31ClN6O3/c22-13-18(29)16(8-4-10-26-21(24)25)27-19(30)17-9-5-11-28(17)20(31)15(23)12-14-6-2-1-3-7-14/h1-3,6-7,15-17H,4-5,8-13,23H2,(H,27,30)(H4,24,25,26)/t15-,16+,17+/m1/s1

InChIKey

KWPACVJPAFGBEQ-IKGGRYGDSA-N

Chemical Structure

2D Structure

CAS: 71142-71-7

CID: 5311176

Formula: C21H31ClN6O3

MW: 451.0

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	451.0
XLogP3	0.2
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	11
Exact Mass	450.2146166
Monoisotopic Mass	450.2146166
Topological Polar Surface Area	157 Å²
Heavy Atom Count	31
Formal Charge	0
Complexity	649
Isotope Atom Count	0
Defined Atom Stereocenter Count	3
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
HY-122542	PPACK
1848-5	PPACK Dihydrochloride
GTR19224470-01	Ppack trifluoroacetate
T25976-01	Ppack HCl
HY-122543A	PPACK II
A16048-25	PPACK 25mg
HY-122542B-01	PPACK (TFA)
SFA03663-01	PPACK monohydrochloride
HY-122542A-01	PPACK (dihydrochloride)
A16048-50	PPACK 50mg

PPACK

Chemical Information

Alternative Products

Popular Products