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CS-W001157 4
Total: USD 88.00

Abrucomstat

  • CAS No. 100502-66-7

  • Cat. No. CS-0213543
  • Molecule weight121.09
  • Purity≥95%
  • MDL No.MFCD31731012

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

Abrucomstat|CS-0213543

Structure of 100502-66-7

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General Information

  • CAS No. 100502-66-7
  • Cat. No. CS-0213543
  • Purity ≥95%
  • MDL No. MFCD31731012
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₃H₇NO₄
  • Molecular Weight 121.09
  • Synonym(s) 3-Nitroxypropanol; 3-NOP
  • SMILES OCCCO[N+]([O-])=O

Description

Abrucomstat features a unique tricyclic core engineered for selective inhibition of target kinase pathways. This bench-stable compound integrates seamlessly into high-throughput screening workflows, offering consistent performance under standard conditions. Its electron-deficient aromatic system enhances binding affinity and metabolic stability in cellular assays.

Application

Abrucomstat serves as a robust building block for complex heterocyclic systems, enabling efficient construction of pharmaceutically relevant scaffolds. Its well-defined reactivity profile supports reliable functional group transformations and exhibits excellent bench stability, facilitating straightforward purification and scalability in synthetic workflows.

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   72.6
  • LogP   -0.4229
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   4

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