Products for Research Use Only
RegisterLogin

VA4 TG2 inhibitor

CAT: 0931-T69933-01Size: 25 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-T69933-01Size:25 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
2088001-23-2
Target
Glutaminase, Others
Related Pathways
Others, Proteases/Proteasome
Bioactivity
VA4 is a novel irreversible TG2 transamidase site-specific inhibitor.
Smiles
S(=O)(=O)(C=1C2=C(C(N(C)C)=CC=C2)C=CC1)N3CCN(C([C@@H](NC(OCC4=CC=CC=C4)=O)CCCCNC(C=C)=O)=O)CC3
Molecular Formula
C33H41N5O6S
Molecular Weight
635.77
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

N-(5-Chloro-2-methylphenyl)-4-(4-fluorophenyl)-2,4-dioxobutanamide
CAS Number2088001-23-2
PubChem CID134821025
IUPAC NameN-(5-chloro-2-methylphenyl)-4-(4-fluorophenyl)-2,4-dioxobutanamide
Molecular FormulaC17H13ClFNO3
Molecular Weight333.7
XLogP3.6
Topological Polar Surface Area63.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count23
Formal Charge0
Complexity463
SMILES
CC1=C(C=C(C=C1)Cl)NC(=O)C(=O)CC(=O)C2=CC=C(C=C2)F
InChI
InChI=1S/C17H13ClFNO3/c1-10-2-5-12(18)8-14(10)20-17(23)16(22)9-15(21)11-3-6-13(19)7-4-11/h2-8H,9H2,1H3,(H,20,23)
InChIKey
LCMOHFZGRVNOPO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(5-Chloro-2-methylphenyl)-4-(4-fluorophenyl)-2,4-dioxobutanamide
CAS: 2088001-23-2
CID: 134821025
Formula: C17H13ClFNO3
MW: 333.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight333.7
XLogP33.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass333.0567991
Monoisotopic Mass333.0567991
Topological Polar Surface Area63.2 Ų
Heavy Atom Count23
Formal Charge0
Complexity463
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
T28137-01NC9 TG2 inhibitor
T69878-01AA9 TG2 inhibitor
T29086-01VA5 TG2 inhibitor
T26494-01AA10 TG2 inhibitor
T70413-01TG2-IN-3h
T83855-01TG2-179-1
T79505-01PROTAC TG2 degrader-1
T79315-01PROTAC TG2 degrader-2
T37222-01GLS1 Inhibitor
T22195-01CBFβ Inhibitor

Alternative Products

CatalogName
105-350Ribunuclease Inhibitor / RNase Inhibitor
880001Inhibitor A
TBI1188-25MGXanthohumol, VCP inhibitor / Autophagy inhibitor
TBI2547-10MGFAK inhibitor 14, FAK inhibitor
SF2784-10mMAKT inhibitor VIII (Akt inhibitor)
GTR17853717C1 Inhibitor (Esterase Inhibitor) Antibody
TBI2616-5MGOridonin, HSP70 inhibitor; Inflammasome inhibitor
TBI2877-200UGConglobatin, NFAT inhibitor; HSP90 inhibitor
TBI2567-1MGHerbimycin A, HSP90 inhibitor; Src inhibitor
TBI2047-50MGDRB, Transcription inhibitor; CK2 inhibitor

Popular Products