Products for Research Use Only

YGZ-331

CAT: 0013-GTR19239348-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19239348-02Size:50 mg
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Description
YGZ-331 is a sedative-hypnotic adenosine nucleoside derivative that elevates GABA levels by activating A1 and A2a receptors and inhibiting CaMKII phosphorylation. It is used in neuroscience research to study sleep, anxiety, and motor activity, as demonstrated by its reduction of spontaneous locomotion in murine models.
CAS Number
1350113-04-0
Field of Research
Neuroscience, Pharmacology & Drug Discovery
Smiles
N ([C@@H] (CC) C1=CC=CC=C1) C2=C3C (N (C=N3) [C@@H]4O[C@H] (CO) [C@@H] (O) [C@H]4O) =NC=N2
Molecular Formula
C19H23N5O4
Molecular Weight
385.42
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

N6-[(S)-1-(phenyl)-propyl]-adenosine
CAS Number1350113-04-0
PubChem CID54282370
IUPAC Name(2R,3S,4R,5R)-2-(hydroxymethyl)-5-[6-[[(1S)-1-phenylpropyl]amino]purin-9-yl]oxolane-3,4-diol
Molecular FormulaC19H23N5O4
Molecular Weight385.4
XLogP2
Topological Polar Surface Area126
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count8
Rotatable Bond Count6
Heavy Atom Count28
Formal Charge0
Complexity509
SMILES
CC[C@@H](C1=CC=CC=C1)NC2=C3C(=NC=N2)N(C=N3)[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O
InChI
InChI=1S/C19H23N5O4/c1-2-12(11-6-4-3-5-7-11)23-17-14-18(21-9-20-17)24(10-22-14)19-16(27)15(26)13(8-25)28-19/h3-7,9-10,12-13,15-16,19,25-27H,2,8H2,1H3,(H,20,21,23)/t12-,13+,15+,16+,19+/m0/s1
InChIKey
RRRLUFHDFDNPMZ-BPAMBQHCSA-N
Chemical Structure
2D Structure
2D structure of N6-[(S)-1-(phenyl)-propyl]-adenosine
CAS: 1350113-04-0
CID: 54282370
Formula: C19H23N5O4
MW: 385.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight385.4
XLogP32
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count8
Rotatable Bond Count6
Exact Mass385.17500423
Monoisotopic Mass385.17500423
Topological Polar Surface Area126 Ų
Heavy Atom Count28
Formal Charge0
Complexity509
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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