Products for Research Use Only
RegisterLogin

BMS-813160

CAT: 0013-GTR19170524-02Size: 5 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19170524-02Size:5 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
BMS-813160 is a novel small molecule and the first dual antagonist of the CCR2 and CCR5 chemokine receptors to advance into clinical trials for cardiovascular indications. It serves as a key research tool for investigating the roles of these receptors in atherosclerosis and inflammation through in vitro binding assays and in vivo disease models.
CAS Number
1286279-29-5
Product Name Alternative
CCR5, CC chemokine receptor, CD11b, dual antagonist, CTX, CCR, CCR2, BMS 813160, BMS813160, BMS-813160, mouse, inhibit, Inhibitor, inflammation, oral, peritonitis, thioglycollate
Field of Research
Immunology & Inflammation, Infectious Disease & Virology, Pharmacology & Drug Discovery
Purity
99.66% (May vary between batches)
Solubility
DMSO:55 mg/mL (113.49 mM) ;10% DMSO+40% PEG300+5% Tween 80+45% Saline:2 mg/mL (4.13 mM)
Smiles
CC (=O) N[C@@H]1C[C@@H] (CC[C@@H]1N1CC[C@H] (Nc2ncnc3cc (nn23) C (C) (C) C) C1=O) NC (C) (C) C
Molecular Formula
C25H40N8O2
Molecular Weight
484.64
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Bms-813160

BMS-813160 is under investigation in clinical trial NCT03496662 (BMS-813160 With Nivolumab and Gemcitabine and Nab-paclitaxel in Borderline Resectable and Locally Advanced Pancreatic Ductal Adenocarcinoma (PDAC)).

CAS Number1286279-29-5
PubChem CID51039119
IUPAC NameN-[(1R,2S,5R)-5-(tert-butylamino)-2-[(3S)-3-[(7-tert-butylpyrazolo[1,5-a][1,3,5]triazin-4-yl)amino]-2-oxopyrrolidin-1-yl]cyclohexyl]acetamide
Molecular FormulaC25H40N8O2
Molecular Weight484.6
XLogP2.7
Topological Polar Surface Area117
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Heavy Atom Count35
Formal Charge0
Complexity778
SMILES
CC(=O)N[C@@H]1C[C@@H](CC[C@@H]1N2CC[C@@H](C2=O)NC3=NC=NC4=CC(=NN43)C(C)(C)C)NC(C)(C)C
InChI
InChI=1S/C25H40N8O2/c1-15(34)28-18-12-16(30-25(5,6)7)8-9-19(18)32-11-10-17(22(32)35)29-23-27-14-26-21-13-20(24(2,3)4)31-33(21)23/h13-14,16-19,30H,8-12H2,1-7H3,(H,28,34)(H,26,27,29)/t16-,17+,18-,19+/m1/s1
InChIKey
CMVHFGNTABZQJU-HCXYKTFWSA-N
Chemical Structure
2D Structure
2D structure of Bms-813160
CAS: 1286279-29-5
CID: 51039119
Formula: C25H40N8O2
MW: 484.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight484.6
XLogP32.7
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Exact Mass484.32742255
Monoisotopic Mass484.32742255
Topological Polar Surface Area117 Ų
Heavy Atom Count35
Formal Charge0
Complexity778
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
GTR19155611-01BMS-986242
GTR19160164-01BMS-303141
GTR19159719-01BMS-927711
GTR19159688-01BMS-3
GTR19236195-01BMS-986397
GTR19231993-01BMS-986365
GTR19219909-01BMS-502
GTR19218041-01BMS-496
GTR19213370BMS-963272
GTR19213348BMS-820132

Alternative Products

CatalogName
BA5245-5.1BMS-813160
BB164193-01BMS 813160
A17040-50BMS-813160 50mg
A17040-5BMS-813160 5mg
A17040-1BMS-813160 1mg
A17040-500BMS-813160 500mg
A17040-100BMS-813160 100mg
A17040-25BMS-813160 25mg
A17040-10BMS-813160 10mg

Popular Products