CAS 912545-86-9: 3-Chloro-N-[trans-4-(methylamino)cyclohexyl]-N-[[3-(4-pyridinyl)phenyl]methyl]benzo[b]thiophene-2-carboxamide

Description: 3-Chloro-N-[trans-4-(methylamino)cyclohexyl]-N-[[3-(4-pyridinyl)phenyl]methyl]benzo[b]thiophene-2-carboxamide, with CAS number 912545-86-9, is a synthetic organic compound characterized by its complex molecular structure, which includes a benzo[b]thiophene core, a carboxamide functional group, and various substituents that contribute to its pharmacological properties. This compound features a chloro group and a methylamino group attached to a cyclohexyl ring, as well as a pyridinyl-phenyl moiety, indicating potential interactions with biological targets. Its structure suggests it may exhibit specific biological activities, possibly related to central nervous system modulation or other therapeutic effects. The presence of multiple aromatic rings and heteroatoms may enhance its lipophilicity and influence its solubility and permeability. As with many compounds in medicinal chemistry, the precise characteristics, including its stability, reactivity, and biological activity, would depend on the specific conditions under which it is studied. Further research would be necessary to fully elucidate its properties and potential applications in pharmacology.

Formula: C₂₈H₂₈ClN₃OS

InChI: InChI=1/C28H28ClN3OS/c1-30-22-9-11-23(12-10-22)32(28(33)27-26(29)24-7-2-3-8-25(24)34-27)18-19-5-4-6-21(17-19)20-13-15-31-16-14-20/h2-8,13-17,22-23,30H,9-12,18H2,1H3/t22-,23-

InChI key: InChIKey=VFSUUTYAEQOIMW-YHBQERECNA-N

SMILES: O=C(C=1SC=2C=CC=CC2C1Cl)N(CC3=CC=CC(=C3)C=4C=CN=CC4)C5CCC(NC)CC5

3-Chloro-N-[trans-4-(methylamino)cyclohexyl]-N-[[3-(4-pyridinyl)phenyl]methyl]benzo[b]thiophene-2-carboxamide

CAS: 912545-86-9

• Formula: C₂₈H₂₈ClN₃OS
• Purity: 99%
• Color and Shape: Solid
• Molecular weight: 490.0594

SAG

CAS: 912545-86-9

• Purity: 98.88%
• Color and Shape: Solid
• Molecular weight: 490.06g/mol

SAG

CAS: 912545-86-9

• Formula: C₂₈H₂₈ClN₃OS
• Purity: (NMR) ≥ 98.0%
• Color and Shape: Conflicting attributes defined
• Molecular weight: 490.1

SAG

CAS: 912545-86-9

SAG (Smoothened Agonist) is a Smo receptor agonist (EC50=3 nM) that is cell-permeable and selective.

• Formula: C₂₈H₂₈ClN₃OS
• Purity: 98.16% - 98.88%
• Color and Shape: Solid
• Molecular weight: 490.06

SAG dihydrochloride

CAS: 912545-86-9

Dihydrochloride; Agonist of Smoothened; enhancer of neuronal differentiation

• Formula: C₂₈H₂₈ClN₃OS
• Purity: Min. 95%
• Molecular weight: 490.06 g/mol

SAG

CAS: 912545-86-9

Smoothened agonist and activator of the Hedgehog signalling pathway with EC50 of 3 nM. SAG …

• Formula: C₂₈H₂₈ClN₃OS
• Purity: Min. 95%
• Color and Shape: White Powder
• Molecular weight: 490.06 g/mol

SAG

CAS: 912545-86-9

• Formula: C₂₈H₂₈ClN₃OSClHH₂O
• Color and Shape: Neat
• Molecular weight: 599.01