8018-2555 Screening compound: 2-[3-(4-methoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]pyrazine

8018-2555 Screening compound: 2-[3-(4-methoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]pyrazine
8018-2555 Screening compound: 2-[3-(4-methoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]pyrazine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-2555
2-[3-(4-methoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]pyrazine

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

8018-2555

Molecular Formula

C14H10N6OS (C14 H10 N6 OS)

Compound Name

2-[3-(4-methoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]pyrazine

IUPAC name

2-[3-(4-methoxyphenyl)-[124]triazolo[34-b][134]thiadiazol-6-yl]pyrazine

SMILES

COc(cc1)ccc1-c1nnc2sc(-c3nccnc3)nn12

InChI

InChI=1S/C14H10N6OS/c1-21-10-4-2-9(3-5-10)12-17-18-14-20(12)19-13(22-14)11-8-15-6-7-16-11/h2-8H,1H3

InChI Key

XKWMFUGLXFNSOS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06786598

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

310.34

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.846

Distribution Coefficient, logD

1.846

Water Solubility, LogSw

-1.64

Polar Surface Area

59.831

Acid Dissociation Constant (pKa)

33.29

Base Dissociation Constant (pKb)

2.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.14

8018-2555 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Anti-Inflammatory Library (24602 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Immune system

References: we are preparing a list of scientific research reports with 8018-2555 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-2555?
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What is the minimum amount of 8018-2555 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-2555
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-2555
  • 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 8018-2555 available by request