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Chemical structure of NH2-UAMC1110 TFA

GC26305

NH2-UAMC1110 TFA

Also known as 6-(4-aminobutoxy)-N-[2-[(2S)-2-cyano-4,4-difluoropyrrolidin-1-yl]-2-oxoethyl]quinoline-4-carboxamide;2,2,2-trifluoroacetic acid

NH2-UAMC1110 TFA is a UAMC1110 derivative that can be used to synthesize FAPI-QS

ChemicalCAS2990021-73-1MW545.46FormulaC23H24F5N5O5
CAS number
2990021-73-1
Molecular weight
545.46
Formula
C23H24F5N5O5
Solubility
H2O ： 250 mg/mL (458·33 mM; Need ultrasonic)
InChIKey
CCMVWHIZASXFHY-UQKRIMTDSA-N
Catalogue number
GC26305
Brand
GLPBIO
Computed properties PubChem CID 163197094 · TPSA 159 Ų · H-bond donors 3 · H-bond acceptors 13
TPSA
159 Ų
H-bond donors
3
H-bond acceptors
13
Rotatable bonds
8
Heavy atoms
38

SMILES C1[C@H](N(CC1(F)F)C(=O)CNC(=O)C2=C3C=C(C=CC3=NC=C2)OCCCCN)C#N.C(=O)(C(F)(F)F)O

Computed descriptors from PubChem (CID 163197094), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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