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CS-W001157 4
Total: USD 88.00
  • CAS No. 1599440-33-1

  • Cat. No. CS-0044752
  • Purity≥98%
  • MDL No.MFCD31657444

*For research and further manufacturing use only, not for direct human use.

DXd|CS-0044752

Structure of 1599440-33-1

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General Information

  • CAS No. 1599440-33-1
  • Cat. No. CS-0044752
  • Purity ≥98%
  • MDL No. MFCD31657444
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₂₆H₂₄FN₃O₆
  • Molecular Weight 493.48
  • Synonym(s) Exatecan derivative for ADC
  • SMILES O=C1[C@](O)(CC)C2=C(CO1)C(N3CC4=C5C6=C(CC[C@@H]5NC(CO)=O)C(C)=C(F)C=C6N=C4C3=C2)=O

Description

Dxd features a robust, electron-deficient core enabling efficient coupling in cross-coupling reactions. This bench-stable reagent integrates seamlessly into synthetic workflows, delivering high functional group tolerance and predictable regioselectivity under standard conditions.

Application

Dxd serves as a robust scaffold for constructing diverse heterocyclic systems, particularly in the synthesis of biologically relevant nitrogen-containing rings. Its well-documented reactivity enables efficient cyclization under mild conditions, offering high functional group tolerance and excellent bench stability. The compound facilitates straightforward access to core frameworks used in medicinal chemistry research, with purification typically achieved via standard chromatographic methods.

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06,GHS09
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H411
Precautionary Statements : P264-P270-P273-P301+P310-P330-P391-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   130.75
  • LogP   1.62292
  • H_Acceptors   8
  • H_Donors   3
  • Rotatable_Bonds   3

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