Brivanib alaninate

CAS Registry Number®

649735-63-7

CAS Name

Brivanib alaninate

Molecular Formula

C22H24FN5O4

Molecular Mass

441.46

Cite this Page

Brivanib alaninate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=649735-63-7 (retrieved 2024-10-05) (CAS RN: 649735-63-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    136-142 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C22H24FN5O4/c1-11-7-15-16(27-11)5-6-17(19(15)23)32-21-20-13(3)18(8-28(20)26-10-25-21)30-9-12(2)31-22(29)14(4)24/h5-8,10,12,14,27H,9,24H2,1-4H3/t12-,14+/m1/s1

InChIKey

InChIKey=LTEJRLHKIYCEOX-OCCSQVGLSA-N

SMILES

O(C=1C=2N(C=C(OC[C@H](OC([C@H](C)N)=O)C)C2C)N=CN1)C=3C(F)=C4C(=CC3)NC(C)=C4

Canonical SMILES

O=C(OC(C)COC1=CN2N=CN=C(OC=3C=CC=4NC(=CC4C3F)C)C2=C1C)C(N)C

Other Names for this Substance

  • L-Alanine, (1R)-2-[[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]oxy]-1-methylethyl ester
  • BMS 582664
  • Brivanib alaninate

Deleted or Replaced CAS Registry Numbers

924262-84-0

CAS INSIGHTSTM
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