Products for Research Use Only

SBI-425

CAT: 0013-GTR19174171-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19174171-01Size:1 mg
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Description
SBI-425
CAS Number
1451272-71-1
Product Name Alternative
SBI425, SBI-425, SBI 425, TNAP, Phosphatase, Inhibitor, inhibit
Field of Research
Metabolism Research
Purity
99.36% (May vary between batches)
Solubility
10% DMSO+40% PEG300+5% Tween 80+45% Saline:3.3 mg/mL (9.66 mM) ; DMSO:80 mg/mL (234.08 mM)
Smiles
COc1ccc (Cl) cc1S (=O) (=O) Nc1cncc (c1) C (N) =O
Molecular Formula
C13H12ClN3O4S
Molecular Weight
341.77
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

5-((5-Chloro-2-methoxyphenyl)sulfonamido)nicotinamide
CAS Number1451272-71-1
PubChem CID89768286
IUPAC Name5-[(5-chloro-2-methoxyphenyl)sulfonylamino]pyridine-3-carboxamide
Molecular FormulaC13H12ClN3O4S
Molecular Weight341.77
XLogP0.9
Topological Polar Surface Area120
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Heavy Atom Count22
Formal Charge0
Complexity496
SMILES
COC1=C(C=C(C=C1)Cl)S(=O)(=O)NC2=CN=CC(=C2)C(=O)N
InChI
InChI=1S/C13H12ClN3O4S/c1-21-11-3-2-9(14)5-12(11)22(19,20)17-10-4-8(13(15)18)6-16-7-10/h2-7,17H,1H3,(H2,15,18)
InChIKey
SBAITEDLNTYIOE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-((5-Chloro-2-methoxyphenyl)sulfonamido)nicotinamide
CAS: 1451272-71-1
CID: 89768286
Formula: C13H12ClN3O4S
MW: 341.77
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight341.77
XLogP30.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Exact Mass341.0237047
Monoisotopic Mass341.0237047
Topological Polar Surface Area120 Ų
Heavy Atom Count22
Formal Charge0
Complexity496
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes