Zolertine

CAS Registry Number®

4004-94-8

CAS Name

Zolertine

Molecular Formula

C13H18N6

Molecular Mass

258.32

Cite this Page

Zolertine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=4004-94-8 (retrieved 2024-11-21) (CAS RN: 4004-94-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    200-203 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C13H18N6/c1-2-4-12(5-3-1)19-10-8-18(9-11-19)7-6-13-14-16-17-15-13/h1-5H,6-11H2,(H,14,15,16,17)

InChIKey

InChIKey=XTTHMUYLNLEJRS-UHFFFAOYSA-N

SMILES

C(CC=1NN=NN1)N2CCN(CC2)C3=CC=CC=C3

Canonical SMILES

N1=NNC(=N1)CCN2CCN(C=3C=CC=CC3)CC2

Other Names for this Substance

  • Piperazine, 1-phenyl-4-[2-(2H-tetrazol-5-yl)ethyl]-
  • Piperazine, 1-phenyl-4-[2-(1H-tetrazol-5-yl)ethyl]-
  • Piperazine, 1-phenyl-4-(2-tetrazol-5-ylethyl)-
  • 1-Phenyl-4-[2-(2H-tetrazol-5-yl)ethyl]piperazine
  • 1-Phenyl-4-(2-tetrazol-5-ylethyl)piperazine

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Deleted or Replaced CAS Registry Numbers

13349-20-7

CAS INSIGHTSTM
Targeted protein degrader structure, illustration