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SU11271

CAT: 0931-T68901-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T68901-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
669764-16-3
Target
Others
Related Pathways
Others
Bioactivity
SU11271 is a potent c-MET inhibitor with potential anticancer activity.
Smiles
C(=C\1/C=2C(NC1=O)=CC=C(S(=O)(=O)N3C=4C(CC3)=CC=CC4)C2)\C5=C(C)C(C(=O)N6CCN(C)CC6)=C(C)N5
Molecular Formula
C29H31N5O4S
Molecular Weight
545.65
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

(Z)-3-((3,5-dimethyl-4-(4-methylpiperazine-1-carbonyl)-1H-pyrrol-2-yl)methylene)-5-(indolin-1-ylsulfonyl)indolin-2-one
CAS Number669764-16-3
PubChem CID11387226
IUPAC Name(3Z)-5-(2,3-dihydroindol-1-ylsulfonyl)-3-[[3,5-dimethyl-4-(4-methylpiperazine-1-carbonyl)-1H-pyrrol-2-yl]methylidene]-1H-indol-2-one
Molecular FormulaC29H31N5O4S
Molecular Weight545.7
XLogP2.5
Topological Polar Surface Area114
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Heavy Atom Count39
Formal Charge0
Complexity1100
SMILES
CC1=C(NC(=C1C(=O)N2CCN(CC2)C)C)/C=C\3/C4=C(C=CC(=C4)S(=O)(=O)N5CCC6=CC=CC=C65)NC3=O
InChI
InChI=1S/C29H31N5O4S/c1-18-25(30-19(2)27(18)29(36)33-14-12-32(3)13-15-33)17-23-22-16-21(8-9-24(22)31-28(23)35)39(37,38)34-11-10-20-6-4-5-7-26(20)34/h4-9,16-17,30H,10-15H2,1-3H3,(H,31,35)/b23-17-
InChIKey
MHTSQKQLTZCFPE-QJOMJCCJSA-N
Chemical Structure
2D Structure
2D structure of (Z)-3-((3,5-dimethyl-4-(4-methylpiperazine-1-carbonyl)-1H-pyrrol-2-yl)methylene)-5-(indolin-1-ylsulfonyl)indolin-2-one
CAS: 669764-16-3
CID: 11387226
Formula: C29H31N5O4S
MW: 545.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight545.7
XLogP32.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass545.20967566
Monoisotopic Mass545.20967566
Topological Polar Surface Area114 Ų
Heavy Atom Count39
Formal Charge0
Complexity1100
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

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