Mizoribine 10mg

CAT: 0628-A10597-10Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0628-A10597-10Size:10 mg

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CAS Number

50924-49-7

Chemical Information

Mizoribine

Mizoribine is a member of imidazoles. It has a role as an anticoronaviral agent.

CAS Number	50924-49-7
PubChem CID	104762
IUPAC Name	1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-hydroxyimidazole-4-carboxamide
Molecular Formula	C9H13N3O6
Molecular Weight	259.22
XLogP	-1.9
Topological Polar Surface Area	151
Hydrogen Bond Donor Count	5
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	3
Heavy Atom Count	18
Formal Charge	0
Complexity	329

SMILES

C1=NC(=C(N1[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O)O)C(=O)N

InChI

InChI=1S/C9H13N3O6/c10-7(16)4-8(17)12(2-11-4)9-6(15)5(14)3(1-13)18-9/h2-3,5-6,9,13-15,17H,1H2,(H2,10,16)/t3-,5-,6-,9-/m1/s1

InChIKey

HZQDCMWJEBCWBR-UUOKFMHZSA-N

Chemical Structure

2D Structure

CAS: 50924-49-7

CID: 104762

Formula: C9H13N3O6

MW: 259.22

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	259.22
XLogP3	-1.9
Hydrogen Bond Donor Count	5
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	3
Exact Mass	259.08043514
Monoisotopic Mass	259.08043514
Topological Polar Surface Area	151 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	329
Isotope Atom Count	0
Defined Atom Stereocenter Count	4
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
B1472-25	Mizoribine