Fostamatinib disodium

C₂₃H₃₆FN₆Na₂O₁₅PCAS 914295-16-2732.52 g/mol

Open in Covalent MOL file

Amide Aryl halide Ether Lactam Phosphate Secondary amine

Properties

Molecular formula: C₂₃H₃₆FN₆Na₂O₁₅P
Molar mass: 732.52 g/mol
Exact mass: 732.1756 Da
logP: -9.11Crippen estimate
Polar surface area: 381.4 Å²
H-bond donors / acceptors: 2 / 14
Rotatable bonds: 10

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

914295-16-2

SMILES

CC1(C(=O)N(C2=C(O1)C=CC(=N2)NC3=NC(=NC=C3F)NC4=CC(=C(C(=C4)OC)OC)OC)COP(=O)([O-])[O-])C.O.O.O.O.O.O.[Na+].[Na+]

InChIKey

ZQGJCHHKJNSPMS-UHFFFAOYSA-L

InChI

InChI=1S/C23H26FN6O9P.2Na.6H2O/c1-23(2)21(31)30(11-38-40(32,33)34)20-14(39-23)6-7-17(28-20)27-19-13(24)10-25-22(29-19)26-12-8-15(35-3)18(37-5)16(9-12)36-4;;;;;;;;/h6-10H,11H2,1-5H3,(H2,32,33,34)(H2,25,26,27,28,29);;;6*1H2/q;2*+1;;;;;;/p-2

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Names and synonyms

1 names

Fostamatinib disodium hexahydrate

Work with Fostamatinib disodium

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Fostamatinib901119-35-552 % similar R406841290-81-151 % similar 6-[[5-Fluoro-2-[(3,4,5-trimethoxyphenyl)amino]-4-pyrimidinyl]amino]-2,2-dimethyl-2H-pyrido[3,2-b]-1,4-oxazin-3(4H)-one841290-80-040 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook