Products for Research Use Only
RegisterLogin

LY2979165 (free base)

CAT: 0804-HY-13239ASize: 1 EachDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0804-HY-13239ASize:1 Each
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
LY2979165 free base is the alanine proagent of 2812223, a selective and potent orthosteric mGlu2 receptor agonist[1].
CAS Number
1311385-35-9
UNSPSC
12352005
Target
MGluR
Type
Reference compound
Related Pathways
GPCR/G Protein; Neuronal Signaling
Field of Research
Neurological Disease
Assay Protocol
https://www.medchemexpress.com/ly2979165-free-base.html
Smiles
[H][C@]12[C@](C(O)=O)(C[C@H]([C@]1([C@@H]2C(O)=O)[H])SC3=NN=CN3)NC([C@H](C)N)=O
Molecular Formula
C13H17N5O5S
Molecular Weight
355.37
References & Citations
[1]Juliet McColm , et al. Evaluation of Single and Multiple Doses of a Novel mGlu2 Agonist, a Potential Antipsychotic Therapy, in Healthy Subjects. Br J Clin Pharmacol. 2017 Aug;83 (8) :1654-1667.|[2]Mitul A Mehta, et al. Group II metabotropic glutamate receptor agonist prodrugs LY2979165 and LY2140023 attenuate the functional imaging response to ketamine in healthy subjects. Psychopharmacology (Berl) . 2018 Jul;235 (7) :1875-1886.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
Phase 1

Chemical Information

LY-2979165
CAS Number1311385-35-9
PubChem CID53246986
IUPAC Name(1R,2S,4R,5R,6R)-2-[[(2S)-2-aminopropanoyl]amino]-4-(1H-1,2,4-triazol-5-ylsulfanyl)bicyclo[3.1.0]hexane-2,6-dicarboxylic acid
Molecular FormulaC13H17N5O5S
Molecular Weight355.37
XLogP-3.2
Topological Polar Surface Area197
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count9
Rotatable Bond Count6
Heavy Atom Count24
Formal Charge0
Complexity577
SMILES
C[C@@H](C(=O)N[C@]1(C[C@H]([C@@H]2[C@H]1[C@H]2C(=O)O)SC3=NC=NN3)C(=O)O)N
InChI
InChI=1S/C13H17N5O5S/c1-4(14)9(19)17-13(11(22)23)2-5(24-12-15-3-16-18-12)6-7(8(6)13)10(20)21/h3-8H,2,14H2,1H3,(H,17,19)(H,20,21)(H,22,23)(H,15,16,18)/t4-,5+,6-,7-,8-,13-/m0/s1
InChIKey
BBGHHIUQOKQCBW-LDZWZCGGSA-N
Chemical Structure
2D Structure
2D structure of LY-2979165
CAS: 1311385-35-9
CID: 53246986
Formula: C13H17N5O5S
MW: 355.37
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight355.37
XLogP3-3.2
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count9
Rotatable Bond Count6
Exact Mass355.09503983
Monoisotopic Mass355.09503983
Topological Polar Surface Area197 Ų
Heavy Atom Count24
Formal Charge0
Complexity577
Isotope Atom Count0
Defined Atom Stereocenter Count6
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
HY-13239-01LY2979165
HY-109118Masupirdine (free base)
HY-152852-01Mefatinib (free base)
HY-19651-01Zanapezil (free base)
HY-116031ATC0175 (free base)
HY-120421SW116 (free base)
HY-139806SRA880 (free base)
HY-100444-01SIS3 (free base)
HY-116565A-01Usmarapride (free base)
HY-125741-01GW768505A (free base)

Alternative Products

CatalogName
TB0954TMB free base
A8893-10Rucaparib (free base)
FX56092-01Xylazine - free base
T-8100-01Tryptamine, free base
XN175452-01Norharman - free base
MBS5779607Amidantel free base
533249ML355 free base
414310Neamine Free Base
596942Carnosine free base
562503NG25 free base

Popular Products