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T338C Src-IN-2

CAT: 0013-GTR19204695-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19204695-01Size:25 mg
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Description
T338C Src-IN-2 is a potent small molecule inhibitor targeting the c-Src T338C mutant kinase with an IC50 of 317 nM, showing enhanced activity against the T338C/V323A and T338C/V323S double mutants. This compound is a valuable research tool for studying Src kinase signaling pathways in cellular and biochemical assays.
CAS Number
1351927-00-8
Field of Research
Cardiovascular Research, Signal Transduction
Smiles
C (C=1C=2C (N (C (C) C) N1) =NC=NC2N) C3=CC (C (CF) =O) =CC=C3
Molecular Formula
C17H18FN5O
Molecular Weight
327.36
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

T338C Src-IN-2
CAS Number1351927-00-8
PubChem CID54751746
IUPAC Name1-[3-[(4-amino-1-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-yl)methyl]phenyl]-2-fluoroethanone
Molecular FormulaC17H18FN5O
Molecular Weight327.36
XLogP2.6
Topological Polar Surface Area86.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Heavy Atom Count24
Formal Charge0
Complexity449
SMILES
CC(C)N1C2=NC=NC(=C2C(=N1)CC3=CC(=CC=C3)C(=O)CF)N
InChI
InChI=1S/C17H18FN5O/c1-10(2)23-17-15(16(19)20-9-21-17)13(22-23)7-11-4-3-5-12(6-11)14(24)8-18/h3-6,9-10H,7-8H2,1-2H3,(H2,19,20,21)
InChIKey
WEPKWIAJJGCTLW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of T338C Src-IN-2
CAS: 1351927-00-8
CID: 54751746
Formula: C17H18FN5O
MW: 327.36
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight327.36
XLogP32.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Exact Mass327.14953838
Monoisotopic Mass327.14953838
Topological Polar Surface Area86.7 Ų
Heavy Atom Count24
Formal Charge0
Complexity449
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

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