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

CAS Registry Number®

1211565-11-5
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CAS Name

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

Molecular Formula

C23H25F6N3O2

Molecular Mass

489.45

Cite this Page

3-[[3,5-Bis(trifluoromethyl)phenyl]amino]-4-[[(1R,2R)-2-(1-piperidinyl)cyclohexyl]amino]-3-cyclobutene-1,2-dione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1211565-11-5 (retrieved 2024-08-13) (CAS RN: 1211565-11-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    136-138 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C23H25F6N3O2/c24-22(25,26)13-10-14(23(27,28)29)12-15(11-13)30-18-19(21(34)20(18)33)31-16-6-2-3-7-17(16)32-8-4-1-5-9-32/h10-12,16-17,30-31H,1-9H2/t16-,17-/m1/s1

InChIKey

InChIKey=XUZPZFXQOUOXFH-IAGOWNOFSA-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)N4CCCCC4

Canonical SMILES

O=C1C(=O)C(NC2CCCCC2N3CCCCC3)=C1NC=4C=C(C=C(C4)C(F)(F)F)C(F)(F)F

Other Names for this Substance

  • 3-Cyclobutene-1,2-dione, 3-[[3,5-bis(trifluoromethyl)phenyl]amino]-4-[[(1R,2R)-2-(1-piperidinyl)cyclohexyl]amino]-
  • 3-[[3,5-Bis(trifluoromethyl)phenyl]amino]-4-[[(1R,2R)-2-(1-piperidinyl)cyclohexyl]amino]-3-cyclobutene-1,2-dione