SA05-0950 Screening compound: 7-[2-(2-fluorophenyl)acetyl]-N,N,3-trimethyl-5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyrazine-8-carboxamide

SA05-0950 Screening compound: 7-[2-(2-fluorophenyl)acetyl]-N,N,3-trimethyl-5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyrazine-8-carboxamide
SA05-0950 Screening compound: 7-[2-(2-fluorophenyl)acetyl]-N,N,3-trimethyl-5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyrazine-8-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SA05-0950
7-[2-(2-fluorophenyl)acetyl]-N,N,3-trimethyl-5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyrazine-8-carboxamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

SA05-0950

Molecular Formula

C17H20FN5O2 (C17 H20 FN5 O2)

Compound Name

7-[2-(2-fluorophenyl)acetyl]-N,N,3-trimethyl-5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyrazine-8-carboxamide

IUPAC name

7-[2-(2-fluorophenyl)acetyl]-NN3-trimethyl-5H6H7H8H-[124]triazolo[43-a]pyrazine-8-carboxamide

SMILES

Cc1nnc(C2C(N(C)C)=O)n1CCN2C(Cc(cccc1)c1F)=O

InChI

InChI=1S/C17H20FN5O2/c1-11-19-20-16-15(17(25)21(2)3)23(9-8-22(11)16)14(24)10-12-6-4-5-7-13(12)18/h4-7,15H,8-10H2,1-3H3/t15-/m1/s1

InChI Key

AHPQKJGZEBBFEG-OAHLLOKOSA-N

MDL Number (MFCD)

MFCD32233865

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

345.38

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.110

Distribution Coefficient, logD

0.110

Water Solubility, LogSw

-1.31

Polar Surface Area

56.444

Acid Dissociation Constant (pKa)

17.63

Base Dissociation Constant (pKb)

3.10

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

41.18

SA05-0950 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS MPO Library (28609 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Ion Channels Focused Library (26372 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Nervous system
  • Cardiovascular
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with SA05-0950 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA05-0950?
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What is the minimum amount of SA05-0950 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA05-0950
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA05-0950
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of SA05-0950 available by request