8019-8359 Screening compound: 4,6-dimethyl-2-{3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}thieno[2,3-b]pyridin-3-amine

8019-8359 Screening compound: 4,6-dimethyl-2-{3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}thieno[2,3-b]pyridin-3-amine
8019-8359 Screening compound: 4,6-dimethyl-2-{3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}thieno[2,3-b]pyridin-3-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-8359
4,6-dimethyl-2-{3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}thieno[2,3-b]pyridin-3-amine

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

8019-8359

Molecular Formula

C18H13F3N4OS (C18 H13 F3 N4 OS)

Compound Name

4,6-dimethyl-2-{3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}thieno[2,3-b]pyridin-3-amine

IUPAC name

46-dimethyl-2-{3-[4-(trifluoromethyl)phenyl]-124-oxadiazol-5-yl}thieno[23-b]pyridin-3-amine

SMILES

Cc1c(c(N)c(-c2nc(-c3ccc(C(F)(F)F)cc3)no2)s2)c2nc(C)c1

InChI

InChI=1S/C18H13F3N4OS/c1-8-7-9(2)23-17-12(8)13(22)14(27-17)16-24-15(25-26-16)10-3-5-11(6-4-10)18(19,20)21/h3-7H,22H2,1-2H3

InChI Key

DSTCGXDVUUOZQT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12033793

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.39

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.432

Distribution Coefficient, logD

5.430

Water Solubility, LogSw

-5.70

Polar Surface Area

60.557

Acid Dissociation Constant (pKa)

22.08

Base Dissociation Constant (pKb)

5.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

8019-8359 in Drug Discovery

Included in Screening Libraries

Ion Channels Focused Library (26372 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8019-8359 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of 8019-8359 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-8359
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-8359
  • 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 8019-8359 available by request