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CAS 830346-49-1

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1,1-Dimethylethyl N-[(1R)-2-[5-bromo-3-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-3,6-dihydro-4-methyl-2,6-dioxo-1(2H)-pyrimidinyl]-1-phenylethyl]carbamate

Description:
1,1-Dimethylethyl N-[(1R)-2-[5-bromo-3-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-3,6-dihydro-4-methyl-2,6-dioxo-1(2H)-pyrimidinyl]-1-phenylethyl]carbamate, with CAS number 830346-49-1, is a complex organic compound characterized by its intricate molecular structure, which includes multiple functional groups such as carbamates and halogens. This compound features a dimethyl group, contributing to its steric bulk, and a pyrimidine ring that is substituted with various functional groups, enhancing its potential biological activity. The presence of bromine and fluorine atoms suggests that it may exhibit unique electronic properties, potentially influencing its reactivity and interactions with biological targets. The compound's chirality, indicated by the (1R) configuration, may also play a significant role in its pharmacological profile, affecting how it interacts with enzymes or receptors in biological systems. Overall, this substance is likely to be of interest in medicinal chemistry and drug development due to its structural complexity and potential therapeutic applications.
Formula:C26H26BrF4N3O4
InChI:InChI=1S/C26H26BrF4N3O4/c1-15-21(27)22(35)34(14-20(16-9-6-5-7-10-16)32-23(36)38-25(2,3)4)24(37)33(15)13-17-18(26(29,30)31)11-8-12-19(17)28/h5-12,20H,13-14H2,1-4H3,(H,32,36)/t20-/m0/s1
InChI key:InChIKey=BYAMYPDENAIRDK-FQEVSTJZSA-N
SMILES:C(C1=C(C(F)(F)F)C=CC=C1F)N2C(=O)N(C[C@H](NC(OC(C)(C)C)=O)C3=CC=CC=C3)C(=O)C(Br)=C2C
Synonyms:
  • Carbamic acid, [(1R)-2-[5-bromo-3-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-3,6-dihydro-4-methyl-2,6-dioxo-1(2H)-pyrimidinyl]-1-phenylethyl]-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl N-[(1R)-2-[5-bromo-3-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-3,6-dihydro-4-methyl-2,6-dioxo-1(2H)-pyrimidinyl]-1-phenylethyl]carbamate
  • Carbamic acid, N-[(1R)-2-[5-bromo-3-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-3,6-dihydro-4-methyl-2,6-dioxo-1(2H)-pyrimidinyl]-1-phenylethyl]-, 1,1-dimethylethyl ester
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