Products for Research Use Only

DW14800

CAT: 1410-M26185-05Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1410-M26185-05Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
DW14800 is an inhibitor of PRMT5 (IC50 = 17 nM), enhances the transcription of HNF4α, and reduces the level of H4R3me2s.
CAS Number
2243709-60-4
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
512.64
Molecular Formula
C31H36N4O3
Notes
Research use only, not for human use.
Receptor
——

Chemical Information

CID 138454790
CAS Number2243709-60-4
PubChem CID138454790
IUPAC NameN-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-2-[4-(dimethylamino)benzoyl]-3,4-dihydro-1H-isoquinoline-6-carboxamide
Molecular FormulaC31H36N4O3
Molecular Weight512.6
XLogP3.3
Topological Polar Surface Area76.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Heavy Atom Count38
Formal Charge0
Complexity798
SMILES
CN(C)C1=CC=C(C=C1)C(=O)N2CCC3=C(C2)C=CC(=C3)C(=O)NCC(CN4CCC5=CC=CC=C5C4)O
InChI
InChI=1S/C31H36N4O3/c1-33(2)28-11-9-23(10-12-28)31(38)35-16-14-24-17-25(7-8-27(24)20-35)30(37)32-18-29(36)21-34-15-13-22-5-3-4-6-26(22)19-34/h3-12,17,29,36H,13-16,18-21H2,1-2H3,(H,32,37)
InChIKey
MQBNHAAEDHNZCH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of CID 138454790
CAS: 2243709-60-4
CID: 138454790
Formula: C31H36N4O3
MW: 512.6
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight512.6
XLogP33.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Exact Mass512.27874102
Monoisotopic Mass512.27874102
Topological Polar Surface Area76.1 Ų
Heavy Atom Count38
Formal Charge0
Complexity798
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes