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OTS193320

CAT: 1410-M13286-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1410-M13286-02Size:5 mg
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Description
OTS193320 (OTS-193320) is a potent inhibitor of protein methyltransferase SUV39H2 with IC50 of 22.2 nM.
CAS Number
2093401-33-1
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
536.029
Molecular Formula
C28H30ClN5O4
Notes
Research use only, not for human use.
Receptor
HMTase

Chemical Information

cis-N1-(2-(5-Chloro-2,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-7-yl)-N4-(4-nitrobenzyl)cyclohexane-1,4-diamine
CAS Number2093401-33-1
PubChem CID134817271
IUPAC Name4-N-[2-(5-chloro-2,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-7-yl]-1-N-[(4-nitrophenyl)methyl]cyclohexane-1,4-diamine
Molecular FormulaC28H30ClN5O4
Molecular Weight536.0
XLogP6.2
Topological Polar Surface Area106
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count8
Heavy Atom Count38
Formal Charge0
Complexity758
SMILES
COC1=CC(=C(C=C1C2=CN3C=CC(=CC3=N2)NC4CCC(CC4)NCC5=CC=C(C=C5)[N+](=O)[O-])Cl)OC
InChI
InChI=1S/C28H30ClN5O4/c1-37-26-15-27(38-2)24(29)14-23(26)25-17-33-12-11-21(13-28(33)32-25)31-20-7-5-19(6-8-20)30-16-18-3-9-22(10-4-18)34(35)36/h3-4,9-15,17,19-20,30-31H,5-8,16H2,1-2H3
InChIKey
LGYQCBXDHOTMJD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of cis-N1-(2-(5-Chloro-2,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-7-yl)-N4-(4-nitrobenzyl)cyclohexane-1,4-diamine
CAS: 2093401-33-1
CID: 134817271
Formula: C28H30ClN5O4
MW: 536.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight536.0
XLogP36.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count8
Exact Mass535.1986321
Monoisotopic Mass535.1986321
Topological Polar Surface Area106 Ų
Heavy Atom Count38
Formal Charge0
Complexity758
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

Alternative Products

CatalogName
HY-122182-01OTS193320

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