ChemicalBook--->CAS DataBase List--->946002-48-8

946002-48-8

946002-48-8 Structure

946002-48-8 Structure
IdentificationBack Directory
[Name]

3-chloro-4,7-difluoro-N-(2-Methoxy-5-(pyridin-4-yl)benzyl)-N-(4-(MethylaMino)cyclohexyl)benzo[b]thiophene-2-carboxaMide
[CAS]

946002-48-8
[Synonyms]

SAG 21k
3-chloro-4,7-difluoro-N-(2-Methoxy-5-(pyridin-4-yl)benzyl)-N-(4-(MethylaMino)cyclohexyl)benzo[b]thiophene-2-carboxaMide
trans-3-chloro-4,7-difluoro-benzo[b]thiophene-2-carboxylic acid (2-methoxy-5-pyridin-4-yl-benzyl)-(4-methylamino-cyclohexyl)-amide
3-Chloro-4,7-difluoro-N-[[2-methoxy-5-(4-pyridinyl)phenyl]methyl]-N-trans-4-(methylamino)cyclohexyl]benzo[b]thiophene-2-carboxamide
[Molecular Formula]

C29H28ClF2N3O2S
[MDL Number]

MFCD30536359
[MOL File]

946002-48-8.mol
[Molecular Weight]

556.07
Chemical PropertiesBack Directory
[Boiling point ]

707.9±60.0 °C(Predicted)
[density ]

1.36±0.1 g/cm3(Predicted)
[storage temp. ]

Store at -20°C
[solubility ]

Soluble in DMSO
[form ]

Solid
[pka]

10.60±0.40(Predicted)
[color ]

Off-white to light yellow
[InChIKey]

YVIFQUJDZSAFKG-MEMLXQNLSA-N
[SMILES]

C12=C(F)C=CC(F)=C1C(Cl)=C(C(N(CC1=CC(C3C=CN=CC=3)=CC=C1OC)[C@@H]1CC[C@@H](NC)CC1)=O)S2
Hazard InformationBack Directory
[Uses]

SAG 21k is a potent agonist of the Hedgehog signaling pathway.
[storage]

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

3-chloro-4,7-difluoro-N-(2-Methoxy-5-(pyridin-4-yl)benzyl)-N-(4-(MethylaMino)cyclohexyl)benzo[b]thiophene-2-carboxaMide(946002-48-8)1HNMR
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