EIPA hydrochloride

CAT: 0926-VDC83928-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0926-VDC83928-01Size:50 mg

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CAS Number

1345839-28-2

Smiles

CCN (c1nc (N) c (nc1Cl) C (=O) NC (=N) N) C (C) C.Cl

Molecular Formula

C11H19Cl2N7O

Molecular Weight

336.22 g/mol

Controlled

Chemical Information

EIPA hydrochloride

CAS Number	1345839-28-2
PubChem CID	56935648
IUPAC Name	3-amino-6-chloro-N-(diaminomethylidene)-5-[ethyl(propan-2-yl)amino]pyrazine-2-carboxamide;hydrochloride
Molecular Formula	C11H19Cl2N7O
Molecular Weight	336.22
Topological Polar Surface Area	137
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	4
Heavy Atom Count	21
Formal Charge	0
Complexity	372

SMILES

CCN(C1=NC(=C(N=C1Cl)C(=O)N=C(N)N)N)C(C)C.Cl

InChI

InChI=1S/C11H18ClN7O.ClH/c1-4-19(5(2)3)9-7(12)16-6(8(13)17-9)10(20)18-11(14)15;/h5H,4H2,1-3H3,(H2,13,17)(H4,14,15,18,20);1H

InChIKey

BGHBOQNLQNKPFO-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1345839-28-2

CID: 56935648

Formula: C11H19Cl2N7O

MW: 336.22

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	336.22
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	4
Exact Mass	335.1028136
Monoisotopic Mass	335.1028136
Topological Polar Surface Area	137 Å²
Heavy Atom Count	21
Formal Charge	0
Complexity	372
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	2
Compound Is Canonicalized	Yes

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Catalog	Name
E5822-5mg	EIPA hydrochloride
HY-101840A-01	EIPA (hydrochloride)
HY-101840AR-01	EIPA (hydrochloride) (Standard)
A21441-10	EIPA hydrochloride 10mg
A21441-100	EIPA hydrochloride 100mg
A21441-50	EIPA hydrochloride 50mg
A21441-5	EIPA hydrochloride 5mg
MBS3844542-01	EIPA