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302964-08-5

302964-08-5 Structure

302964-08-5 Structure
IdentificationMore
[Name]

N-(2-Chloro-6-methylphenyl)-2-[(6-chloro-2-methyl-4-pyrimidinyl)amino]-5-thiazolecarboxamide
[CAS]

302964-08-5
[Synonyms]

N-(2-CHLORO-6-METHYLPHENYL)-2-[(6-CHLORO-2-METHYL-4-PYRIMIDINYL)AMINO]-5-THIAZOLECARBOXAMIDE
2-(6-Chloro-2-methylpyrimidin-4-ylamino)-N-(2-chloro-6-methylphenyl)thiazole-5-carboxamide
[EINECS(EC#)]

695-686-7
[Molecular Formula]

C16H13Cl2N5OS
[MDL Number]

MFCD11045075
[Molecular Weight]

394.28
[MOL File]

302964-08-5.mol
Chemical PropertiesBack Directory
[Melting point ]

333-335°C
[Boiling point ]

566.95° C (Predicted)
[density ]

1.516±0.06 g/cm3(Predicted)
[refractive index ]

n20D 1.72 (Predicted)
[storage temp. ]

Inert atmosphere,2-8°C
[solubility ]

DMSO (Slightly)
[form ]

Solid
[pka]

10.92±0.70(Predicted)
[color ]

Pale Yellow
[Water Solubility ]

Slightly soluble in water
[Usage]

Dasatinib intermediate. A protein tyrosine kinase inhibitor
[InChI]

InChI=1S/C16H13Cl2N5OS/c1-8-4-3-5-10(17)14(8)23-15(24)11-7-19-16(25-11)22-13-6-12(18)20-9(2)21-13/h3-7H,1-2H3,(H,23,24)(H,19,20,21,22)
[InChIKey]

LMXUWARKUIELGT-UHFFFAOYSA-N
[SMILES]

S1C(C(NC2=C(C)C=CC=C2Cl)=O)=CN=C1NC1C=C(Cl)N=C(C)N=1
[CAS DataBase Reference]

302964-08-5(CAS DataBase Reference)
Safety DataBack Directory
[HS Code ]

2933399990
Hazard InformationBack Directory
[Description]

N-(2-Chloro-6-methylphenyl)-2-[(6-chloro-2-methyl-4-pyrimidinyl)amino]-5-thiazolecarboxamide is a pharmaceutical intermediate compound used as a synthetic intermediate for dasatinib. Dasatinib is a targeted anticancer drug used to treat chronic myeloid leukaemia (CML) and Philadelphia chromosome-positive acute lymphoblastic leukaemia (ALL). It is also a receptor and non-receptor Tyk (tyrosine kinase) inhibitor, which plays an important role in certain cancers and fibrotic diseases.
[Chemical Properties]

Pale Yellow Solid
[Uses]

Dasatinib intermediate. A protein tyrosine kinase inhibitor
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