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CAS 1211565-10-4

:

3-[[3,5-Bis(trifluoromethyl)phenyl]amino]-4-[[(1R,2R)-2-(1-pyrrolidinyl)cyclohexyl]amino]-3-cyclobutene-1,2-dione

Description:
The chemical substance known as "3-[[3,5-Bis(trifluoromethyl)phenyl]amino]-4-[[(1R,2R)-2-(1-pyrrolidinyl)cyclohexyl]amino]-3-cyclobutene-1,2-dione" with CAS number 1211565-10-4 is a complex organic compound characterized by its unique structural features. It contains multiple functional groups, including an amino group and a cyclobutene dione moiety, which contribute to its reactivity and potential biological activity. The presence of trifluoromethyl groups enhances its lipophilicity and may influence its pharmacokinetic properties. The compound's stereochemistry, indicated by the (1R,2R) configuration, suggests specific spatial arrangements that could affect its interaction with biological targets. This substance may exhibit significant activity in medicinal chemistry, particularly in the development of pharmaceuticals, due to its intricate structure and the potential for diverse interactions within biological systems. Its synthesis and characterization would require advanced techniques in organic chemistry, and its applications could span various fields, including drug discovery and material science.
Formula:C22H23F6N3O2
InChI:InChI=1S/C22H23F6N3O2/c23-21(24,25)12-9-13(22(26,27)28)11-14(10-12)29-17-18(20(33)19(17)32)30-15-5-1-2-6-16(15)31-7-3-4-8-31/h9-11,15-16,29-30H,1-8H2/t15-,16-/m1/s1
InChI key:InChIKey=CRIYFAISGRLYEW-HZPDHXFCSA-N
SMILES:N(C1=C(NC2=CC(C(F)(F)F)=CC(C(F)(F)F)=C2)C(=O)C1=O)[C@H]3[C@@H](CCCC3)N4CCCC4
Synonyms:
  • 3-[[3,5-Bis(trifluoromethyl)phenyl]amino]-4-[[(1R,2R)-2-(1-pyrrolidinyl)cyclohexyl]amino]-3-cyclobutene-1,2-dione
  • 3-Cyclobutene-1,2-dione, 3-[[3,5-bis(trifluoromethyl)phenyl]amino]-4-[[(1R,2R)-2-(1-pyrrolidinyl)cyclohexyl]amino]-
  • 3-[[3,5-bis(trifluoroMethyl)phenyl]aMino]-4-[[(1S,2S)-2-(1-pyrrolidinyl)cyclohexyl]aMino]-
  • (1-pyrrolidinyl)cyclohexyl]amino]-3-cyclobutene-1,2-
  • dione
  • 3-[[3,5-Bis(trifluoromethyl)phenyl]amino]-4-[[(1R,2R)-2-
  • 3-((3,5-Bis(trifluoromethyl)phenyl)amino)-4-(((1R,2R)-2-(pyrrolidin-1-yl)cyclohexyl)amino)cyclobut-3-ene-1,2-dione
  • dione,99%e.e.
  • 3-[[3,5-Bis(trifluoromethyl)phenyl]amino]-4-[[(1R,2R)-2-(1-pyrrolidinyl)cyclohexyl]amino]-3-cyclobutene-1,2-dione, 98%, (99% ee)
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