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1448440-52-5

1448440-52-5 Structure

1448440-52-5 Structure
IdentificationBack Directory
[Name]

(S)-N-(2-(2-cyano-4,4-difluoropyrrolidin-1-yl)-2-oxoethyl)quinoline-4-carboxamide
[CAS]

1448440-52-5
[Synonyms]

CS-2845
SP-13786
UAMC-1110
(S)-N-(2-(2-cyano-4,4-difluoropyrrolidin-1-yl)-2-oxoethyl)quinoline-4-carboxamide
(S)-N-[2-(2-Cyano-4,4-difluoro-1-pyrrolidinyl)-2-oxoethyl]quinoline-4-carboxamide
4-Quinolinecarboxamide, N-[2-[(2S)-2-cyano-4,4-difluoro-1-pyrrolidinyl]-2-oxoethyl]-
(S)-N-(2-(2-Cyano-4,4-difluoropyrrolidin-1-yl)-2-oxoethyl)quinoline-4-carboxamide (UAMC1110)
[Molecular Formula]

C17H14F2N4O2
[MDL Number]

MFCD29477499
[MOL File]

1448440-52-5.mol
[Molecular Weight]

344.32
Chemical PropertiesBack Directory
[Melting point ]

>70°C (Decomposed)
[Boiling point ]

676.4±55.0 °C(Predicted)
[density ]

1.42±0.1 g/cm3(Predicted)
[storage temp. ]

Hygroscopic, -20°C Freezer, Under inert atmosphere
[solubility ]

Chloroform (Sparingly), Methanol (Slightly)
[form ]

Solid
[pka]

12.43±0.46(Predicted)
[color ]

Off-White to Pale Yellow
[Stability:]

Hygroscopic
[InChI]

InChI=1S/C17H14F2N4O2/c18-17(19)7-11(8-20)23(10-17)15(24)9-22-16(25)13-5-6-21-14-4-2-1-3-12(13)14/h1-6,11H,7,9-10H2,(H,22,25)/t11-/m0/s1
[InChIKey]

PUOOCZVRHBHJRS-NSHDSACASA-N
[SMILES]

N1C2C(=CC=CC=2)C(C(NCC(N2CC(F)(F)C[C@H]2C#N)=O)=O)=CC=1
Hazard InformationBack Directory
[Uses]

UAMC1110 is a useful research chemical and a fibroblast activation protein inhibitor displaying low nanomolar inhibitory potency and high selectivity against related dipeptidyl peptidases.
[in vivo]

UAMC-1110 is the most extensive and prolonged inhibitior of FAP in the PK studies. Pharmacokinetic evaluation in mice of UAMC-1110 demonstrates high oral bioavailability, plasma half-life, and the potential to selectively and completely inhibit FAP in vivo[1].

Spectrum DetailBack Directory
[Spectrum Detail]

(S)-N-(2-(2-cyano-4,4-difluoropyrrolidin-1-yl)-2-oxoethyl)quinoline-4-carboxamide(1448440-52-5)1HNMR
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