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MPT0B014

CAT: 0931-T67769-02Size: 1 mL - 10 mM (in DMSO)Dry Ice: NoHazardous: No
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CAT#:0931-T67769-02Size:1 mL - 10 mM (in DMSO)
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1215208-59-5
Target
Microtubule Associated, Apoptosis
Related Pathways
Cytoskeletal Signaling, Apoptosis
Purity
0.9956
Bioactivity
MPT0B014 is a potent tubulin polymerization inhibitor. MPT0B014 can induce cancer cell apoptosis.
Smiles
COc1cc(cc(OC)c1OC)C(=O)c1ccc2ncccc2c1
Molecular Formula
C19H17NO4
Molecular Weight
323.34
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

6-(3',4',5'-Trimethoxybenzoyl)quinoline

has antineoplastic activity; structure in first source

CAS Number1215208-59-5
PubChem CID45139642
IUPAC Namequinolin-6-yl-(3,4,5-trimethoxyphenyl)methanone
Molecular FormulaC19H17NO4
Molecular Weight323.3
XLogP3.2
Topological Polar Surface Area57.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count24
Formal Charge0
Complexity416
SMILES
COC1=CC(=CC(=C1OC)OC)C(=O)C2=CC3=C(C=C2)N=CC=C3
InChI
InChI=1S/C19H17NO4/c1-22-16-10-14(11-17(23-2)19(16)24-3)18(21)13-6-7-15-12(9-13)5-4-8-20-15/h4-11H,1-3H3
InChIKey
GSGXITQZCMSYKF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 6-(3',4',5'-Trimethoxybenzoyl)quinoline
CAS: 1215208-59-5
CID: 45139642
Formula: C19H17NO4
MW: 323.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight323.3
XLogP33.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass323.11575802
Monoisotopic Mass323.11575802
Topological Polar Surface Area57.7 Ų
Heavy Atom Count24
Formal Charge0
Complexity416
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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