(2S)-2-(Dimethylamino)-N-[(3R,4S,7S)-5,8-dioxo-3-phenyl-7-(phenylmethyl)-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-10,12,14,15-tetraen-4-yl]-3-methylbutanamide

CAS Registry Number®

17948-40-2

CAS Name

(2S)-2-(Dimethylamino)-N-[(3R,4S,7S)-5,8-dioxo-3-phenyl-7-(phenylmethyl)-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-10,12,14,15-tetraen-4-yl]-3-methylbutanamide

Molecular Formula

C33H38N4O4

Molecular Mass

554.68

Cite this Page

(2S)-2-(Dimethylamino)-N-[(3R,4S,7S)-5,8-dioxo-3-phenyl-7-(phenylmethyl)-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-10,12,14,15-tetraen-4-yl]-3-methylbutanamide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=17948-40-2 (retrieved 2024-11-22) (CAS RN: 17948-40-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    285 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C33H38N4O4/c1-22(2)29(37(3)4)33(40)36-28-30(25-13-9-6-10-14-25)41-26-17-15-23(16-18-26)19-20-34-31(38)27(35-32(28)39)21-24-11-7-5-8-12-24/h5-20,22,27-30H,21H2,1-4H3,(H,34,38)(H,35,39)(H,36,40)/t27-,28-,29-,30+/m0/s1

InChIKey

InChIKey=QMQZKCJJHAIMPG-GCXHJFECSA-N

SMILES

N(C([C@H](C(C)C)N(C)C)=O)[C@H]1[C@H](OC=2C=CC(=CC2)C=CNC(=O)[C@H](CC3=CC=CC=C3)NC1=O)C4=CC=CC=C4

Canonical SMILES

O=C1NC=CC=2C=CC(OC(C=3C=CC=CC3)C(NC(=O)C(N(C)C)C(C)C)C(=O)NC1CC=4C=CC=CC4)=CC2

Other Names for this Substance

  • Butanamide, 2-(dimethylamino)-N-[(3R,4S,7S)-5,8-dioxo-3-phenyl-7-(phenylmethyl)-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-10,12,14,15-tetraen-4-yl]-3-methyl-, (2S)-
  • Integerressine
  • Butanamide, 2-(dimethylamino)-N-[5,8-dioxo-3-phenyl-7-(phenylmethyl)-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-10,12,14,15-tetraen-4-yl]-3-methyl-, [3R-[3R*,4S*(S*),7S*]]-
  • 2-Oxa-6,9-diazabicyclo[10.2.2]hexadecane, butanamide deriv.
  • (2S)-2-(Dimethylamino)-N-[(3R,4S,7S)-5,8-dioxo-3-phenyl-7-(phenylmethyl)-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-10,12,14,15-tetraen-4-yl]-3-methylbutanamide

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