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Y06137

CAT: 0013-GTR19175620-04Size: 1 ml x 10 mM (in DMSO)Dry Ice: NoHazardous: No
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CAT#:0013-GTR19175620-04Size:1 ml x 10 mM (in DMSO)
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Y06137
CAS Number
2226534-49-0
Product Name Alternative
BRD4 (1), BRD41, inhibit, Epigenetic Reader Domain, EpigeneticReaderDomain, Inhibitor, Y 06137, Y06137, Y-06137
Field of Research
Epigenetics & Chromatin, Signal Transduction
Purity
97.27% (May vary between batches)
Solubility
DMSO:65 mg/mL (146.21 mM) ;10% DMSO+40% PEG300+5% Tween 80+45% Saline:2 mg/mL (4.5 mM)
Smiles
C[C@H]1COCCN1c1ccc2nc (-c3ccc4onc (C) c4c3) n (CC3CCCCC3) c2c1
Molecular Formula
C27H32N4O2
Molecular Weight
444.57
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

5-[1-(Cyclohexylmethyl)-6-[(3S)-3-methylmorpholin-4-yl]benzimidazol-2-yl]-3-methyl-1,2-benzoxazole
CAS Number2226534-49-0
PubChem CID137333445
IUPAC Name5-[1-(cyclohexylmethyl)-6-[(3S)-3-methylmorpholin-4-yl]benzimidazol-2-yl]-3-methyl-1,2-benzoxazole
Molecular FormulaC27H32N4O2
Molecular Weight444.6
XLogP5.8
Topological Polar Surface Area56.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count33
Formal Charge0
Complexity658
SMILES
C[C@H]1COCCN1C2=CC3=C(C=C2)N=C(N3CC4CCCCC4)C5=CC6=C(C=C5)ON=C6C
InChI
InChI=1S/C27H32N4O2/c1-18-17-32-13-12-30(18)22-9-10-24-25(15-22)31(16-20-6-4-3-5-7-20)27(28-24)21-8-11-26-23(14-21)19(2)29-33-26/h8-11,14-15,18,20H,3-7,12-13,16-17H2,1-2H3/t18-/m0/s1
InChIKey
JYCNBHVRGVCHIQ-SFHVURJKSA-N
Chemical Structure
2D Structure
2D structure of 5-[1-(Cyclohexylmethyl)-6-[(3S)-3-methylmorpholin-4-yl]benzimidazol-2-yl]-3-methyl-1,2-benzoxazole
CAS: 2226534-49-0
CID: 137333445
Formula: C27H32N4O2
MW: 444.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight444.6
XLogP35.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass444.25252628
Monoisotopic Mass444.25252628
Topological Polar Surface Area56.3 Ų
Heavy Atom Count33
Formal Charge0
Complexity658
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

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Alternative Products

CatalogName
BA4750-5.1Y06137
A19656-50Y06137 50mg
A19656-25Y06137 25mg
A19656-10Y06137 10mg
A19656-5Y06137 5mg
A19656-2Y06137 2mg
A19656-1Y06137 1mg
A19656-100Y06137 100mg
A19656-10mM-DY06137 10mM * 1mL in DMSO

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