Nizatidine Amide

CAT: 0024-sc-478114Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-478114Size:100 mg

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CAS Number

188666-11-7

Chemical Information

Nizatidine Amide

CAS Number	188666-11-7
PubChem CID	87655011
IUPAC Name	N-[2-[[2-[(dimethylamino)methyl]-1,3-thiazol-4-yl]methylsulfanyl]ethyl]-2-nitroacetamide
Molecular Formula	C11H18N4O3S2
Molecular Weight	318.4
XLogP	0.6
Topological Polar Surface Area	145
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	8
Heavy Atom Count	20
Formal Charge	0
Complexity	325

SMILES

CN(C)CC1=NC(=CS1)CSCCNC(=O)C[N+](=O)[O-]

InChI

InChI=1S/C11H18N4O3S2/c1-14(2)6-11-13-9(8-20-11)7-19-4-3-12-10(16)5-15(17)18/h8H,3-7H2,1-2H3,(H,12,16)

InChIKey

SVJOOHIZNUJXJK-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 188666-11-7

CID: 87655011

Formula: C11H18N4O3S2

MW: 318.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	318.4
XLogP3	0.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	8
Exact Mass	318.08203280
Monoisotopic Mass	318.08203280
Topological Polar Surface Area	145 Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	325
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
GTR19209906-01	Nizatidine amide
AR-N01678-01	Nizatidine EP Impurity E (Nizatidine Amide)
AR-N08912-01	Nizatidine EP Impurity E HCl (Nizatidine Amide HCl)
B1552-1000	Nizatidine