CAS 229005-80-5: N-[[4-[[[6,7-Dihydro-2-(4-methylphenyl)-5H-benzocyclohepten-8-yl]carbonyl]amino]phenyl]methyl]tetrahydro-N,N-dimethyl-2H-pyran-4-aminium chloride (1:1)

Description: N-[[4-[[[6,7-Dihydro-2-(4-methylphenyl)-5H-benzocyclohepten-8-yl]carbonyl]amino]phenyl]methyl]tetrahydro-N,N-dimethyl-2H-pyran-4-aminium chloride (1:1), with CAS number 229005-80-5, is a complex organic compound characterized by its unique structural features, including a tetrahydro-pyran moiety and a benzocycloheptene framework. This compound exhibits quaternary ammonium characteristics due to the presence of a dimethylamino group, which contributes to its solubility in polar solvents. The presence of multiple aromatic rings suggests potential for π-π stacking interactions, which may influence its biological activity and stability. The compound's chloride salt form indicates it is likely to be more soluble in aqueous environments, enhancing its potential applications in pharmaceutical formulations. Additionally, the presence of carbonyl and amino functional groups suggests reactivity that could be exploited in further chemical modifications or in biological interactions. Overall, this compound's intricate structure and functional groups may confer specific pharmacological properties, making it of interest in medicinal chemistry and drug development.

Formula: C₃₃H₃₉N₂O₂·Cl

InChI: InChI=1S/C33H38N2O2.ClH/c1-24-7-11-27(12-8-24)28-14-13-26-5-4-6-29(22-30(26)21-28)33(36)34-31-15-9-25(10-16-31)23-35(2,3)32-17-19-37-20-18-32;/h7-16,21-22,32H,4-6,17-20,23H2,1-3H3;1H

InChI key: InChIKey=VDALIBWXVQVFGZ-UHFFFAOYSA-N

SMILES: [Cl-].O=C(NC1=CC=C(C=C1)C[N+](C)(C)C2CCOCC2)C3=CC4=CC(=CC=C4CCC3)C=5C=CC(=CC5)C

Synonyms:

• 2H-Pyran-4-aminium, N-[[4-[[[6,7-dihydro-2-(4-methylphenyl)-5H-benzocyclohepten-8-yl]carbonyl]amino]phenyl]methyl]tetrahydro-N,N-dimethyl-, chloride
• 2H-Pyran-4-aminium, N-[[4-[[[6,7-dihydro-2-(4-methylphenyl)-5H-benzocyclohepten-8-yl]carbonyl]amino]phenyl]methyl]tetrahydro-N,N-dimethyl-, chloride (1:1)
• N,N-dimethyl-N-[4-({[2-(4-methylphenyl)-6,7-dihydro-5H-benzo[7]annulen-8-yl]carbonyl}amino)benzyl]tetrahydro-2H-pyran-4-aminium chloride
• N-[[4-[[[6,7-Dihydro-2-(4-methylphenyl)-5H-benzocyclohepten-8-yl]carbonyl]amino]phenyl]methyl]tetrahydro-N,N-dimethyl-2H-pyran-4-aminium chloride (1:1)
• Tak 799
• Tak-779
• Takeda 779

Tak 799

CAS: 229005-80-5

• Formula: C₃₃H₃₉ClN₂O₂
• Purity: 98%
• Color and Shape: Solid
• Molecular weight: 531.128

TAK-779

CAS: 229005-80-5

• Purity: ≥98%
• Molecular weight: 531.13g/mol

TAK-779

CAS: 229005-80-5

TAK-779 (Takeda 779) is an antagonist of chemokine receptor 5 (CCR5), CCR2b, and CXC chemokine …

• Formula: C₃₃H₃₉ClN₂O₂
• Purity: 99.21%
• Color and Shape: Solid
• Molecular weight: 531.13

Dimethyl-[[4-[[3-(4-methylphenyl)-8,9-dihydro-7H-benzo[7]annulene-6-carbonyl]amino]phenyl]methyl]-(oxan-4-yl)azanium chloride

CAS: 229005-80-5

Please enquire for more information about Dimethyl-[[4-[[3-(4-methylphenyl)-8,9-dihydro-7H-benzo[7]annulene-6-carbonyl]amino]phenyl]methyl]-(oxan-4-yl)azanium chloride including the price, delivery time and more …

• Formula: C₃₃H₃₉N₂O₂·Cl
• Purity: Min. 95%
• Molecular weight: 531.14 g/mol