BODIPY TMR-X

CAS Registry Number®

217190-15-3

CAS Name

BODIPY TMR-X

Molecular Formula

C31H35BF2N4O6

Cite this Page

BODIPY TMR-X.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=217190-15-3 (retrieved 2024-11-21) (CAS RN: 217190-15-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C31H35BF2N4O6/c1-20-25(13-15-28(39)35-18-6-4-5-7-31(42)44-38-29(40)16-17-30(38)41)21(2)36-27(20)19-23-10-14-26(37(23)32(36,33)34)22-8-11-24(43-3)12-9-22/h8-12,14,19H,4-7,13,15-18H2,1-3H3,(H,35,39)

InChIKey

InChIKey=GRDQURHVJJVDRY-UHFFFAOYSA-N

SMILES

[F-][B+3]1([F-])[N]=2C(=CC=3[N-]1C(C)=C(CCC(NCCCCCC(ON4C(=O)CCC4=O)=O)=O)C3C)C=CC2C5=CC=C(OC)C=C5

Canonical SMILES

O=C(ON1C(=O)CCC1=O)CCCCCNC(=O)CCC=2C(=C3C=C4C=CC(C=5C=CC(OC)=CC5)=[N]4[B+3]([F-])([F-])[N-]3C2C)C

Other Names for this Substance

  • Boron, [N-[6-[(2,5-dioxo-1-pyrrolidinyl)oxy]-6-oxohexyl]-5-[[5-(4-methoxyphenyl)-2H-pyrrol-2-ylidene-κN]methyl]-2,4-dimethyl-1H-pyrrole-3-propanamidato-κN1]difluoro-, (T-4)-
  • (T-4)-[N-[6-[(2,5-Dioxo-1-pyrrolidinyl)oxy]-6-oxohexyl]-5-[[5-(4-methoxyphenyl)-2H-pyrrol-2-ylidene-κN]methyl]-2,4-dimethyl-1H-pyrrole-3-propanamidato-κN1]difluoroboron
  • BODIPY TMR-X,SE
  • BODIPY TMR-X
  • D 6117

View All

Deleted or Replaced CAS Registry Numbers

1304627-64-2

CAS INSIGHTSTM
Targeted protein degrader structure, illustration