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GW-5823

CAT: 0931-T32022-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T32022-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1356689-41-2
Target
Others
Related Pathways
Others
Bioactivity
GW-5823 is a bioactive chemical.
Smiles
COc1ccc(cc1)N(C(C)C)C(=O)CN1c2ccccc2N(c2ccccc2)C(=O)[C@@H](Cc2[nH]nc3ccccc23)C1=O
Molecular Formula
C35H33N5O4
Molecular Weight
587.67
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

GW-5823
CAS Number1356689-41-2
PubChem CID5311148
IUPAC Name2-[3-(2H-indazol-3-ylmethyl)-2,4-dioxo-5-phenyl-1,5-benzodiazepin-1-yl]-N-(4-methoxyphenyl)-N-propan-2-ylacetamide
Molecular FormulaC35H33N5O4
Molecular Weight587.7
XLogP5.6
Topological Polar Surface Area98.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Heavy Atom Count44
Formal Charge0
Complexity1010
SMILES
CC(C)N(C1=CC=C(C=C1)OC)C(=O)CN2C3=CC=CC=C3N(C(=O)C(C2=O)CC4=C5C=CC=CC5=NN4)C6=CC=CC=C6
InChI
InChI=1S/C35H33N5O4/c1-23(2)39(25-17-19-26(44-3)20-18-25)33(41)22-38-31-15-9-10-16-32(31)40(24-11-5-4-6-12-24)35(43)28(34(38)42)21-30-27-13-7-8-14-29(27)36-37-30/h4-20,23,28H,21-22H2,1-3H3,(H,36,37)
InChIKey
LGYKPDHARJMLQN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of GW-5823
CAS: 1356689-41-2
CID: 5311148
Formula: C35H33N5O4
MW: 587.7
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight587.7
XLogP35.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Exact Mass587.25325455
Monoisotopic Mass587.25325455
Topological Polar Surface Area98.8 Ų
Heavy Atom Count44
Formal Charge0
Complexity1010
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