(2-Amino-4,5,6,7-tetrahydro-1-benzothien-3-yl)(phenyl)methanone

CAS: 4651-72-3

Ref. 3D-FA133596

Product Information

• Name: (2-Amino-4,5,6,7-tetrahydro-1-benzothien-3-yl)(phenyl)methanone
• Synonyms: methanone, (2-amino-4,5,6,7-tetrahydrobenzo[b]thien-3-yl)phenyl-, (2-Amino-4,5,6,7-tetrahydrobenzo[b]thien-3-yl)phenylmethanone, (2-Amino-4,5,6,7-tetrahydrobenzo[b]thiophen-3-yl)(phenyl)methanone, 2-Amino-3-benzoyl-4,5,6,7-tetrahydrobenzo[b]thiophene, 2-Amino-3-benzoyl-4,5-tetramethylenethiophene, 3-Benzoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-amine, 3-Benzoyl-4,5,6,7-tetrahydrobenzo[b]thiophen-2-amine, Ketone, 2-amino-4,5,6,7-tetrahydrobenzo[b]thien-3-yl phenyl, Methanone, (2-amino-4,5,6,7-tetrahydrobenzo[b]thien-3-yl)phenyl-, (2-Amino-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)(phenyl)methanone

Description

2-Amino-4,5,6,7-tetrahydro-1-benzothien-3-yl)(phenyl)methanone is a centrosymmetric molecule that crystallizes in the orthorhombic space group Pbca. It has been shown to function as an antagonist of the A1 adenosine receptor, with a binding affinity of 0.9 nM. The crystal structure of 2-amino-4,5,6,7-tetrahydrobenzothieno[2,3-c]pyridine (ATP) bound to the A1 receptor has been determined by single crystal x-ray diffraction and has been used to refine the functional theory parameters for this system. The conformational parameters have also been refined using molecular orbital theory.

• Brand: Biosynth

Chemical properties

• Molecular weight: 257.35 g/mol
• Formula: C₁₅H₁₅NOS
• Purity: Min. 95%