Roscovitine

CAS Registry Number®

186692-46-6

CAS Name

Roscovitine

Molecular Formula

C19H26N6O

Molecular Mass

354.45

Cite this Page

Roscovitine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=186692-46-6 (retrieved 2024-11-21) (CAS RN: 186692-46-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    106-108 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C19H26N6O/c1-4-15(11-26)22-19-23-17(20-10-14-8-6-5-7-9-14)16-18(24-19)25(12-21-16)13(2)3/h5-9,12-13,15,26H,4,10-11H2,1-3H3,(H2,20,22,23,24)/t15-/m1/s1

InChIKey

InChIKey=BTIHMVBBUGXLCJ-OAHLLOKOSA-N

SMILES

C(C)(C)N1C=2C(=C(NCC3=CC=CC=C3)N=C(N[C@H](CC)CO)N2)N=C1

Canonical SMILES

OCC(NC=1N=C(NCC=2C=CC=CC2)C=3N=CN(C3N1)C(C)C)CC

Other Names for this Substance

  • 1-Butanol, 2-[[9-(1-methylethyl)-6-[(phenylmethyl)amino]-9H-purin-2-yl]amino]-, (2R)-
  • 1-Butanol, 2-[[9-(1-methylethyl)-6-[(phenylmethyl)amino]-9H-purin-2-yl]amino]-, (R)-
  • (2R)-2-[[9-(1-Methylethyl)-6-[(phenylmethyl)amino]-9H-purin-2-yl]amino]-1-butanol
  • Roscovitine
  • CYC 202

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration