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BMS817378

CAT: 0931-T7787-04Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T7787-04Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1174161-69-3
Target
VEGFR, c-Met/HGFR
Related Pathways
Tyrosine Kinase/Adaptors, Angiogenesis
Purity
>99.99%
Bioactivity
BMS817378 is a potent and selective inhibitor of MET (IC50 : 1.7 nM) .
Smiles
O=C1C(=CN(COP(=O)(O)O)C=C1C(NC2=CC(F)=C(OC=3C(Cl)=C(N)N=CC3)C=C2)=O)C4=CC=C(F)C=C4
Molecular Formula
C24H18ClF2N4O7P
Molecular Weight
578.85
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

(3-((4-((2-Amino-3-chloropyridin-4-yl)oxy)-3-fluorophenyl)carbamoyl)-5-(4-fluorophenyl)-4-oxopyridin-1(4H)-yl)methyl dihydrogen phosphate
CAS Number1174161-69-3
PubChem CID44137813
IUPAC Name[3-[[4-[(2-amino-3-chloro-4-pyridinyl)oxy]-3-fluorophenyl]carbamoyl]-5-(4-fluorophenyl)-4-oxo-1-pyridinyl]methyl dihydrogen phosphate
Molecular FormulaC24H18ClF2N4O7P
Molecular Weight578.8
XLogP2.2
Topological Polar Surface Area164
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count12
Rotatable Bond Count8
Heavy Atom Count39
Formal Charge0
Complexity1020
SMILES
C1=CC(=CC=C1C2=CN(C=C(C2=O)C(=O)NC3=CC(=C(C=C3)OC4=C(C(=NC=C4)N)Cl)F)COP(=O)(O)O)F
InChI
InChI=1S/C24H18ClF2N4O7P/c25-21-20(7-8-29-23(21)28)38-19-6-5-15(9-18(19)27)30-24(33)17-11-31(12-37-39(34,35)36)10-16(22(17)32)13-1-3-14(26)4-2-13/h1-11H,12H2,(H2,28,29)(H,30,33)(H2,34,35,36)
InChIKey
KXDZWUPUSDCGDD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of (3-((4-((2-Amino-3-chloropyridin-4-yl)oxy)-3-fluorophenyl)carbamoyl)-5-(4-fluorophenyl)-4-oxopyridin-1(4H)-yl)methyl dihydrogen phosphate
CAS: 1174161-69-3
CID: 44137813
Formula: C24H18ClF2N4O7P
MW: 578.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight578.8
XLogP32.2
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count12
Rotatable Bond Count8
Exact Mass578.0569699
Monoisotopic Mass578.0569699
Topological Polar Surface Area164 Ų
Heavy Atom Count39
Formal Charge0
Complexity1020
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

Alternative Products

CatalogName
MBS5758653BMS817378

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