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CAS 209984-58-7

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(αR)-N-[(1S)-2-[[(7S)-6,7-Dihydro-5-methyl-6-oxo-5H-dibenz[b,d]azepin-7-yl]amino]-1-methyl-2-oxoethyl]-3,5-difluoro-α-hydroxybenzeneacetamide

Description:
The chemical substance with the name "(αR)-N-[(1S)-2-[[(7S)-6,7-Dihydro-5-methyl-6-oxo-5H-dibenz[b,d]azepin-7-yl]amino]-1-methyl-2-oxoethyl]-3,5-difluoro-α-hydroxybenzeneacetamide" and CAS number "209984-58-7" is a complex organic compound characterized by its multi-ring structure and specific functional groups. It features a dibenzodiazepine core, which is known for its pharmacological properties, particularly in the realm of neuropharmacology. The presence of difluoro and hydroxy groups suggests potential interactions with biological targets, enhancing its activity or selectivity. The stereochemistry indicated by the (αR) and (1S) designations implies that the compound has specific spatial arrangements that can significantly influence its biological activity and interactions. This compound may exhibit properties such as solubility in organic solvents, potential bioactivity, and specific reactivity due to its functional groups. Overall, its structural complexity and functional diversity make it a candidate for further investigation in medicinal chemistry and drug development.
Formula:C26H23F2N3O4
InChI:InChI=1S/C26H23F2N3O4/c1-14(29-25(34)23(32)15-11-16(27)13-17(28)12-15)24(33)30-22-20-9-4-3-7-18(20)19-8-5-6-10-21(19)31(2)26(22)35/h3-14,22-23,32H,1-2H3,(H,29,34)(H,30,33)/t14-,22-,23+/m0/s1
InChI key:InChIKey=ULSSJYNJIZWPSB-AETJINEWSA-N
SMILES:N(C([C@@H](NC([C@H](O)C1=CC(F)=CC(F)=C1)=O)C)=O)[C@H]2C=3C(C=4C(N(C)C2=O)=CC=CC4)=CC=CC3
Synonyms:
  • (αR)-N-[(1S)-2-[[(7S)-6,7-Dihydro-5-methyl-6-oxo-5H-dibenz[b,d]azepin-7-yl]amino]-1-methyl-2-oxoethyl]-3,5-difluoro-α-hydroxybenzeneacetamide
  • Benzeneacetamide, N-[(1S)-2-[[(7S)-6,7-dihydro-5-methyl-6-oxo-5H-dibenz[b,d]azepin-7-yl]amino]-1-methyl-2-oxoethyl]-3,5-difluoro-α-hydroxy-, (αR)-
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