Gedatolisib

CAS Registry Number®

1197160-78-3

CAS Name

Gedatolisib

Molecular Formula

C32H41N9O4

Molecular Mass

615.73

Cite this Page

Gedatolisib.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1197160-78-3 (retrieved 2024-11-22) (CAS RN: 1197160-78-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C32H41N9O4/c1-38(2)27-11-13-39(14-12-27)29(42)24-5-9-26(10-6-24)34-32(43)33-25-7-3-23(4-8-25)28-35-30(40-15-19-44-20-16-40)37-31(36-28)41-17-21-45-22-18-41/h3-10,27H,11-22H2,1-2H3,(H2,33,34,43)

InChIKey

InChIKey=DWZAEMINVBZMHQ-UHFFFAOYSA-N

SMILES

N(C(NC1=CC=C(C(=O)N2CCC(N(C)C)CC2)C=C1)=O)C3=CC=C(C=4N=C(N=C(N4)N5CCOCC5)N6CCOCC6)C=C3

Canonical SMILES

O=C(NC=1C=CC(=CC1)C=2N=C(N=C(N2)N3CCOCC3)N4CCOCC4)NC5=CC=C(C=C5)C(=O)N6CCC(N(C)C)CC6

Other Names for this Substance

  • Urea, N-[4-[[4-(dimethylamino)-1-piperidinyl]carbonyl]phenyl]-N′-[4-(4,6-di-4-morpholinyl-1,3,5-triazin-2-yl)phenyl]-
  • N-[4-[[4-(Dimethylamino)-1-piperidinyl]carbonyl]phenyl]-N′-[4-(4,6-di-4-morpholinyl-1,3,5-triazin-2-yl)phenyl]urea
  • 1-[4-[[4-(Dimethylamino)piperidin-1-yl]carbonyl]phenyl]-3-[4-[4,6-bis(morpholino)-1,3,5-triazin-2-yl]phenyl]urea
  • PKI 587
  • PK 1587

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration