M4205

CAT: 0127-BUP07639-05Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-BUP07639-05Size:100 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

2590556-80-0

Purity

=98%

Smiles

Cn1cc(cn1)-c1ccc(CNc2cc(ncn2)-c2cnc3cc(OCCCN4CCCC4)ccn23)cc1

Chemical Information

Idrx-42

Velzatinib is an orally bioavailable small molecule inhibitor of multiple mutated forms of mast/stem cell factor receptor KIT (c-Kit; SCFR), with potential antineoplastic activity. Upon oral administration, velzatinib targets, binds to and inhibits specific c-Kit mutants. This may inhibit tumor cell proliferation in cancer cell types that overexpress these c-Kit mutations. c-Kit, a transmembrane protein and receptor tyrosine kinase (RTK) overexpressed in various solid tumors and hematological malignancies, plays a key role in the regulation of cell differentiation and proliferation. Mutant forms of c-Kit are often associated with tumor chemoresistance.

CAS Number	2590556-80-0
PubChem CID	155587867
IUPAC Name	N-[[4-(1-methylpyrazol-4-yl)phenyl]methyl]-6-[7-(3-pyrrolidin-1-ylpropoxy)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-amine
Molecular Formula	C29H32N8O
Molecular Weight	508.6
XLogP	4.3
Topological Polar Surface Area	85.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	10
Heavy Atom Count	38
Formal Charge	0
Complexity	715

SMILES

CN1C=C(C=N1)C2=CC=C(C=C2)CNC3=NC=NC(=C3)C4=CN=C5N4C=CC(=C5)OCCCN6CCCC6

InChI

InChI=1S/C29H32N8O/c1-35-20-24(18-34-35)23-7-5-22(6-8-23)17-30-28-16-26(32-21-33-28)27-19-31-29-15-25(9-13-37(27)29)38-14-4-12-36-10-2-3-11-36/h5-9,13,15-16,18-21H,2-4,10-12,14,17H2,1H3,(H,30,32,33)

InChIKey

LVMAULGVWBINFP-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2590556-80-0

CID: 155587867

Formula: C29H32N8O

MW: 508.6

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	508.6
XLogP3	4.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	10
Exact Mass	508.26990767
Monoisotopic Mass	508.26990767
Topological Polar Surface Area	85.4 Å²
Heavy Atom Count	38
Formal Charge	0
Complexity	715
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
BA8866-5.1	M4205
C14524-5mg	M4205 (IDRX-42)

M4205

Chemical Information

Alternative Products

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