L550-1976 Screening compound: 1-(3-{2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-4-(pyridin-2-yl)piperazine

L550-1976 Screening compound: 1-(3-{2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-4-(pyridin-2-yl)piperazine
L550-1976 Screening compound: 1-(3-{2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-4-(pyridin-2-yl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound L550-1976
1-(3-{2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-4-(pyridin-2-yl)piperazine

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

L550-1976

Molecular Formula

C25H25N9O2 (C25 H25 N9 O2)

Compound Name

1-(3-{2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-4-(pyridin-2-yl)piperazine

IUPAC name

1-(3-{2-[3-(4-methoxyphenyl)-124-oxadiazol-5-yl]ethyl}-[124]triazolo[43-b]pyridazin-6-yl)-4-(pyridin-2-yl)piperazine

SMILES

COc(cc1)ccc1-c1noc(CCc2nnc(cc3)n2nc3N(CC2)CCN2c2ncccc2)n1

InChI

InChI=1S/C25H25N9O2/c1-35-19-7-5-18(6-8-19)25-27-24(36-31-25)12-11-22-29-28-21-9-10-23(30-34(21)22)33-16-14-32(15-17-33)20-4-2-3-13-26-20/h2-10,13H,11-12,14-17H2,1H3

InChI Key

WMXYDVQHMRETKL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27461168

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

483.53

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

4.108

Distribution Coefficient, logD

4.103

Water Solubility, LogSw

-4.18

Polar Surface Area

86.948

Acid Dissociation Constant (pKa)

23.62

Base Dissociation Constant (pKb)

5.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.00

L550-1976 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

KRAS-Targeted Library (16000 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with L550-1976 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L550-1976?
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What is the minimum amount of L550-1976 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L550-1976
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L550-1976
  • 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 L550-1976 available by request