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Golvatinib (E7050)

CAT: 0607-B1439-50Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0607-B1439-50Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
C-Met/VEGFR-2 inhibitor
CAS Number
928037-13-2
Product Name Alternative
1-N'-[2-fluoro-4-[2-[[4-(4-methylpiperazin-1-yl)piperidine-1-carbonyl]amino]pyridin-4-yl]oxyphenyl]-1-N-(4-fluorophenyl)cyclopropane-1,1-dicarboxamide
Field of Research
Tyrosine Kinase c-MET
Purity
0.98
Form
A solid
Solubility
insoluble in H2O; ≥1.39 mg/mL in EtOH with ultrasonic; ≥15.85 mg/mL in DMSO with gentle warming
Smiles
CN1CCN(CC1)C2CCN(CC2)C(=O)NC3=NC=CC(=C3)OC4=CC(=C(C=C4)NC(=O)C5(CC5)C(=O)NC6=CC=C(C=C6)F)F
Molecular Formula
C33H37F2N7O4
Molecular Weight
633.69
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

Golvatinib

Golvatinib is an aromatic ether.

CAS Number928037-13-2
PubChem CID16118392
IUPAC Name1-N'-[2-fluoro-4-[[2-[[4-(4-methylpiperazin-1-yl)piperidine-1-carbonyl]amino]-4-pyridinyl]oxy]phenyl]-1-N-(4-fluorophenyl)cyclopropane-1,1-dicarboxamide
Molecular FormulaC33H37F2N7O4
Molecular Weight633.7
XLogP4.1
Topological Polar Surface Area119
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count9
Rotatable Bond Count8
Heavy Atom Count46
Formal Charge0
Complexity1060
SMILES
CN1CCN(CC1)C2CCN(CC2)C(=O)NC3=NC=CC(=C3)OC4=CC(=C(C=C4)NC(=O)C5(CC5)C(=O)NC6=CC=C(C=C6)F)F
InChI
InChI=1S/C33H37F2N7O4/c1-40-16-18-41(19-17-40)24-9-14-42(15-10-24)32(45)39-29-21-26(8-13-36-29)46-25-6-7-28(27(35)20-25)38-31(44)33(11-12-33)30(43)37-23-4-2-22(34)3-5-23/h2-8,13,20-21,24H,9-12,14-19H2,1H3,(H,37,43)(H,38,44)(H,36,39,45)
InChIKey
UQRCJCNVNUFYDX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Golvatinib
CAS: 928037-13-2
CID: 16118392
Formula: C33H37F2N7O4
MW: 633.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight633.7
XLogP34.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count9
Rotatable Bond Count8
Exact Mass633.28750901
Monoisotopic Mass633.28750901
Topological Polar Surface Area119 Ų
Heavy Atom Count46
Formal Charge0
Complexity1060
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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