6′-[Ethyl(4-methylphenyl)amino]-3′-methyl-2′-(phenylamino)spiro[isobenzofuran-1(3H),9′-[9H]xanthen]-3-one

CAS Registry Number®

59129-79-2

CAS Name

6′-[Ethyl(4-methylphenyl)amino]-3′-methyl-2′-(phenylamino)spiro[isobenzofuran-1(3H),9′-[9H]xanthen]-3-one

Molecular Formula

C36H30N2O3

Molecular Mass

538.64

Cite this Page

6′-[Ethyl(4-methylphenyl)amino]-3′-methyl-2′-(phenylamino)spiro[isobenzofuran-1(3H),9′-[9H]xanthen]-3-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=59129-79-2 (retrieved 2024-11-22) (CAS RN: 59129-79-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    77-78 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C36H30N2O3/c1-4-38(26-16-14-23(2)15-17-26)27-18-19-30-34(21-27)40-33-20-24(3)32(37-25-10-6-5-7-11-25)22-31(33)36(30)29-13-9-8-12-28(29)35(39)41-36/h5-22,37H,4H2,1-3H3

InChIKey

InChIKey=IXHBSOXJLNEOPY-UHFFFAOYSA-N

SMILES

O=C1OC2(C=3C(OC=4C2=CC=C(N(CC)C5=CC=C(C)C=C5)C4)=CC(C)=C(NC6=CC=CC=C6)C3)C=7C1=CC=CC7

Canonical SMILES

O=C1OC2(C3=CC=C(C=C3OC=4C=C(C(=CC42)NC=5C=CC=CC5)C)N(C6=CC=C(C=C6)C)CC)C=7C=CC=CC17

Other Names for this Substance

  • Spiro[isobenzofuran-1(3H),9′-[9H]xanthen]-3-one, 6′-[ethyl(4-methylphenyl)amino]-3′-methyl-2′-(phenylamino)-
  • 6′-[Ethyl(4-methylphenyl)amino]-3′-methyl-2′-(phenylamino)spiro[isobenzofuran-1(3H),9′-[9H]xanthen]-3-one
  • LDK 1003
  • 2′-Phenylamino-3′-methyl-6′-(N-ethyl-p-tolyl)aminofluoran
  • 2′-Anilino-3′-methyl-6′-(N-ethyl-N-p-tolylamino)fluoran

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Deleted or Replaced CAS Registry Numbers

95971-34-9

CAS INSIGHTSTM
Targeted protein degrader structure, illustration