Products for Research Use Only
RegisterLogin

BMS-509744

CAT: 0013-GTR19203910-03Size: 5 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19203910-03Size:5 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
BMS-509744 is a potent and selective ATP-competitive inhibitor of interleukin-2-inducible T-cell kinase (Itk), exhibiting an IC50 of 19 nM. It has demonstrated efficacy in reducing IL-8 expression and HIV infection in vitro, as well as ameliorating pulmonary inflammation in allergic asthma and Imiquimod-induced skin inflammation in murine models.
CAS Number
439575-02-7
Product Name Alternative
BMS 509744, BMS509744, BMS-509744, Itk
Field of Research
Immunology & Inflammation, Infectious Disease & Virology, Protein Biochemistry, Signal Transduction
Purity
99.70% (May vary between batches)
Solubility
10% DMSO+40% PEG300+5% Tween-80+45% Saline:2.5 mg/mL (4.01 mM) ; DMSO:52 mg/mL (83.36 mM)
Smiles
O=C (NC1=NC=C (S1) SC2=CC (=C (OC) C=C2C) C (=O) N3CCN (C (=O) C) CC3) C4=CC=C (C=C4) CNC (C) C (C) (C) C
Molecular Formula
C32H41N5O4S2
Molecular Weight
623.83
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Bms-509744

N-[5-[[5-[(4-acetyl-1-piperazinyl)-oxomethyl]-4-methoxy-2-methylphenyl]thio]-2-thiazolyl]-4-[(3,3-dimethylbutan-2-ylamino)methyl]benzamide is a member of benzamides.

CAS Number439575-02-7
PubChem CID11467730
IUPAC NameN-[5-[5-(4-acetylpiperazine-1-carbonyl)-4-methoxy-2-methylphenyl]sulfanyl-1,3-thiazol-2-yl]-4-[(3,3-dimethylbutan-2-ylamino)methyl]benzamide
Molecular FormulaC32H41N5O4S2
Molecular Weight623.8
XLogP5.1
Topological Polar Surface Area157
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count10
Heavy Atom Count43
Formal Charge0
Complexity949
SMILES
CC1=CC(=C(C=C1SC2=CN=C(S2)NC(=O)C3=CC=C(C=C3)CNC(C)C(C)(C)C)C(=O)N4CCN(CC4)C(=O)C)OC
InChI
InChI=1S/C32H41N5O4S2/c1-20-16-26(41-7)25(30(40)37-14-12-36(13-15-37)22(3)38)17-27(20)42-28-19-34-31(43-28)35-29(39)24-10-8-23(9-11-24)18-33-21(2)32(4,5)6/h8-11,16-17,19,21,33H,12-15,18H2,1-7H3,(H,34,35,39)
InChIKey
ZHXNIYGJAOPMSO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Bms-509744
CAS: 439575-02-7
CID: 11467730
Formula: C32H41N5O4S2
MW: 623.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight623.8
XLogP35.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count10
Exact Mass623.25999715
Monoisotopic Mass623.25999715
Topological Polar Surface Area157 Ų
Heavy Atom Count43
Formal Charge0
Complexity949
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

Related Products

CatalogName
GTR19203908-01BMS-688521
GTR19203907BMS-690514
GTR19203898-01BMS-986163
GTR19236195-01BMS-986397
GTR19231993-01BMS-986365
GTR19171953-01BMS-345541
GTR19168075-01BMS-911543
GTR19167115-01BMS-2
GTR19163585-01BMS-708163
GTR19219909-01BMS-502

Alternative Products

CatalogName
A3250-10BMS-509744
443063-01BMS 509744
A11319-10BMS-509744 10mg
A11319-100BMS-509744 100mg
A11319-50BMS-509744 50mg
A11319-25BMS-509744 25mg
A11319-5BMS-509744 5mg
MBS386661-01BMS-806 (BMS 378806)
A11201-2BMS-806 (BMS 378806) 2mg
A11201-1BMS-806 (BMS 378806) 1mg

Popular Products