GAP-134 Hydrochloride 10mg

CAT: 0628-A15092-10Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0628-A15092-10Size:10 mg

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CAS Number

943133-81-1

Chemical Information

Danegaptide Hydrochloride

CAS Number	943133-81-1
PubChem CID	44563896
IUPAC Name	(2S,4R)-1-(2-aminoacetyl)-4-benzamidopyrrolidine-2-carboxylic acid;hydrochloride
Molecular Formula	C14H18ClN3O4
Molecular Weight	327.76
Topological Polar Surface Area	113
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	4
Heavy Atom Count	22
Formal Charge	0
Complexity	420

SMILES

C1[C@H](CN([C@@H]1C(=O)O)C(=O)CN)NC(=O)C2=CC=CC=C2.Cl

InChI

InChI=1S/C14H17N3O4.ClH/c15-7-12(18)17-8-10(6-11(17)14(20)21)16-13(19)9-4-2-1-3-5-9;/h1-5,10-11H,6-8,15H2,(H,16,19)(H,20,21);1H/t10-,11+;/m1./s1

InChIKey

AHXPMNACLWKFRQ-DHXVBOOMSA-N

Chemical Structure

2D Structure

CAS: 943133-81-1

CID: 44563896

Formula: C14H18ClN3O4

MW: 327.76

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	327.76
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	4
Exact Mass	327.0985838
Monoisotopic Mass	327.0985838
Topological Polar Surface Area	113 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	420
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes

Catalog	Name
A15091-10	GAP-134 10mg
A15092-5	GAP-134 Hydrochloride 5mg
A15092-1	GAP-134 Hydrochloride 1mg
A15092-50	GAP-134 Hydrochloride 50mg
A15092-100	GAP-134 Hydrochloride 100mg
A15092-25	GAP-134 Hydrochloride 25mg
A15092-10mM-D	GAP-134 Hydrochloride 10mM * 1mL in DMSO
A15091-50	GAP-134 50mg
A15091-5	GAP-134 5mg
A14866-10	Gap 27 10mg

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