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OSMI-4

CAT: 1410-M33049-06Size: 100 mgDry Ice: NoHazardous: No
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CAT#:1410-M33049-06Size:100 mg
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Description
OSMI-4 is a low nanomolar O-GlcNAc transferase (OGT) inhibitor (EC50 of 3 μM in cells) that can be used to study OGT inhibition in different human cell lines.
CAS Number
2260791-14-6
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
604.09
Molecular Formula
C27H26ClN3O7S2
Notes
Research use only, not for human use.
Receptor
Others

Chemical Information

Ethyl (R)-N-(2-((7-chloro-2-oxo-1,2-dihydroquinoline)-6-sulfonamido)-2-(2-methoxyphenyl)acetyl)-N-(thiophen-2-ylmethyl)glycinate
CAS Number2260791-14-6
PubChem CID137319721
IUPAC Nameethyl 2-[[(2R)-2-[(7-chloro-2-oxo-1H-quinolin-6-yl)sulfonylamino]-2-(2-methoxyphenyl)acetyl]-(thiophen-2-ylmethyl)amino]acetate
Molecular FormulaC27H26ClN3O7S2
Molecular Weight604.1
XLogP3.6
Topological Polar Surface Area168
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count12
Heavy Atom Count40
Formal Charge0
Complexity1050
SMILES
CCOC(=O)CN(CC1=CC=CS1)C(=O)[C@@H](C2=CC=CC=C2OC)NS(=O)(=O)C3=C(C=C4C(=C3)C=CC(=O)N4)Cl
InChI
InChI=1S/C27H26ClN3O7S2/c1-3-38-25(33)16-31(15-18-7-6-12-39-18)27(34)26(19-8-4-5-9-22(19)37-2)30-40(35,36)23-13-17-10-11-24(32)29-21(17)14-20(23)28/h4-14,26,30H,3,15-16H2,1-2H3,(H,29,32)/t26-/m1/s1
InChIKey
STPSLAZMEWZDAJ-AREMUKBSSA-N
Chemical Structure
2D Structure
2D structure of Ethyl (R)-N-(2-((7-chloro-2-oxo-1,2-dihydroquinoline)-6-sulfonamido)-2-(2-methoxyphenyl)acetyl)-N-(thiophen-2-ylmethyl)glycinate
CAS: 2260791-14-6
CID: 137319721
Formula: C27H26ClN3O7S2
MW: 604.1
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight604.1
XLogP33.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count12
Exact Mass603.0900702
Monoisotopic Mass603.0900702
Topological Polar Surface Area168 Ų
Heavy Atom Count40
Formal Charge0
Complexity1050
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes