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SU11274

CAT: 0127-BUP08717-06Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0127-BUP08717-06Size:100 mg
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CAS Number
658084-23-2
Synonyms
Met Kinase Inhibitor, PKI-SU11274
Purity
=98%
Smiles
C(=C\1/C=2C(NC1=O)=CC=C(S(N(C)C3=CC(Cl)=CC=C3)(=O)=O)C2)\C4=C(C)C(C(=O)N5CCN(C)CC5)=C(C)N4

Chemical Information

SU11274

SU11274 is a member of the class of oxindoles that is 1,3-dihydro-2H-indol-2-one substituted by {3,5-dimethyl-4-[(4-methylpiperazin-1-yl)carbonyl]-1H-pyrrol-2-yl}methylidene and N-(3-chlorophenyl)-N-methylmethanesulfonyl groups at positions 3 and 5, respectively. It is a potent ATP-competitive inhibitor of c-Met (IC50 = 20 nM) and exhibits antineoplastic activity. It has a role as an autophagy inducer, an antineoplastic agent, an apoptosis inducer and a c-Met tyrosine kinase inhibitor. It is a sulfonamide, a member of oxindoles, a N-acylpiperazine, a N-methylpiperazine, a pyrrolecarboxamide, an aromatic ketone, an olefinic compound and a member of monochlorobenzenes.

CAS Number658084-23-2
PubChem CID9549297
IUPAC Name(3Z)-N-(3-chlorophenyl)-3-[[3,5-dimethyl-4-(4-methylpiperazine-1-carbonyl)-1H-pyrrol-2-yl]methylidene]-N-methyl-2-oxo-1H-indole-5-sulfonamide
Molecular FormulaC28H30ClN5O4S
Molecular Weight568.1
XLogP3.1
Topological Polar Surface Area114
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Heavy Atom Count39
Formal Charge0
Complexity1070
SMILES
CC1=C(NC(=C1C(=O)N2CCN(CC2)C)C)/C=C\3/C4=C(C=CC(=C4)S(=O)(=O)N(C)C5=CC(=CC=C5)Cl)NC3=O
InChI
InChI=1S/C28H30ClN5O4S/c1-17-25(30-18(2)26(17)28(36)34-12-10-32(3)11-13-34)16-23-22-15-21(8-9-24(22)31-27(23)35)39(37,38)33(4)20-7-5-6-19(29)14-20/h5-9,14-16,30H,10-13H2,1-4H3,(H,31,35)/b23-16-
InChIKey
FPYJSJDOHRDAMT-KQWNVCNZSA-N
Chemical Structure
2D Structure
2D structure of SU11274
CAS: 658084-23-2
CID: 9549297
Formula: C28H30ClN5O4S
MW: 568.1
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight568.1
XLogP33.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Exact Mass567.1707033
Monoisotopic Mass567.1707033
Topological Polar Surface Area114 Ų
Heavy Atom Count39
Formal Charge0
Complexity1070
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
MBS578719SU11274

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