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1374356-45-2

1374356-45-2 Structure

1374356-45-2 Structure
IdentificationBack Directory
[Name]

2-Pyridinamine, 3-[(1S)-1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-[1-(4-piperidinyl)-1H-pyrazol-4-yl]-
[CAS]

1374356-45-2
[Synonyms]

(s)-g-fitinib
(S)-CRIZOTINIB
ent-crizotinib
Crizotinib, (S)-
Crizotinib S-Isomer
Crizotinib impurity A
Crizotinib Impurity 24
CRIZOTINIB CHIRAL IMPURITY
3-[(1S)-1-(2,6-Dichloro-3-fluorophenyl)ethoxy]-5-[1-(4-piperidinyl)-1H-pyrazol-4-yl]-2-pyridinamine
2-Pyridinamine, 3-[(1S)-1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-[1-(4-piperidinyl)-1H-pyrazol-4-yl]-
[Molecular Formula]

C21H22Cl2FN5O
[MDL Number]

MFCD22126092
[MOL File]

1374356-45-2.mol
[Molecular Weight]

450.34
Chemical PropertiesBack Directory
[Boiling point ]

599.2±50.0 °C(Predicted)
[density ]

1.47±0.1 g/cm3(Predicted)
[storage temp. ]

Store at -20°C
[solubility ]

DMF: 5 mg/ml; DMF:PBS (pH 7.2) (1:1): 0.5 mg/ml; DMSO: 0.5 mg/ml; Ethanol: 0.5 mg/ml
[form ]

A solid
[pka]

9.81±0.10(Predicted)
[color ]

Light yellow to yellow
[CAS DataBase Reference]

1374356-45-2
Hazard InformationBack Directory
[Characteristics]

MTH1 (NUDT1)-selective inhibitor.
[Uses]

(S)-Crizotinib is the S-isomer of Crizotinib (C785000) and a novel potent, selective, and cell permeable MTH1 inhibitor. (S)-Crizotinib can also serve as a promising anticancer agent.
[Definition]

ChEBI: Ent-crizotinib is a 3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-[1-(piperidin-4-yl)pyrazol-4-yl]pyridin-2-amine that is the (S)-enantiomer of crizotinib. It is an enantiomer of a crizotinib.
[Biological Activity]

(S)-crizotinib, (S)enantiomer-crizotinib, is a potent MTH1 (NUDT1) inhibitor with IC50 of 72 nM.
[target]

TargetValue
MTH1
(Cell-free assay)
72 nM
[storage]

Store at -20°C
Spectrum DetailBack Directory
[Spectrum Detail]

2-Pyridinamine, 3-[(1S)-1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-[1-(4-piperidinyl)-1H-pyrazol-4-yl]-(1374356-45-2)1HNMR
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