3-(3-Fluorophenyl)-2-[(1R)-1-(9H-purin-6-ylamino)propyl]-4H-1-benzopyran-4-one

CAS Registry Number®

1639417-54-1

CAS Name

3-(3-Fluorophenyl)-2-[(1R)-1-(9H-purin-6-ylamino)propyl]-4H-1-benzopyran-4-one

Molecular Formula

C23H18FN5O2

Molecular Mass

415.42

Cite this Page

3-(3-Fluorophenyl)-2-[(1R)-1-(9H-purin-6-ylamino)propyl]-4H-1-benzopyran-4-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1639417-54-1 (retrieved 2024-11-21) (CAS RN: 1639417-54-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C23H18FN5O2/c1-2-16(29-23-19-22(26-11-25-19)27-12-28-23)21-18(13-6-5-7-14(24)10-13)20(30)15-8-3-4-9-17(15)31-21/h3-12,16H,2H2,1H3,(H2,25,26,27,28,29)/t16-/m1/s1

InChIKey

InChIKey=HDXDQPRPFRKGKZ-MRXNPFEDSA-N

SMILES

[C@@H](NC1=C2C(N=CN2)=NC=N1)(CC)C3=C(C(=O)C=4C(O3)=CC=CC4)C5=CC(F)=CC=C5

Canonical SMILES

O=C1C=2C=CC=CC2OC(=C1C=3C=CC=C(F)C3)C(NC4=NC=NC=5N=CNC54)CC

Other Names for this Substance

  • 4H-1-Benzopyran-4-one, 3-(3-fluorophenyl)-2-[(1R)-1-(9H-purin-6-ylamino)propyl]-
  • 3-(3-Fluorophenyl)-2-[(1R)-1-(9H-purin-6-ylamino)propyl]-4H-1-benzopyran-4-one

CAS INSIGHTSTM
Targeted protein degrader structure, illustration