8019-3429 Screening compound: 3-[4-(2-fluorobenzoyl)piperazin-1-yl]-1,2-benzothiazole

8019-3429 Screening compound: 3-[4-(2-fluorobenzoyl)piperazin-1-yl]-1,2-benzothiazole
8019-3429 Screening compound: 3-[4-(2-fluorobenzoyl)piperazin-1-yl]-1,2-benzothiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-3429
3-[4-(2-fluorobenzoyl)piperazin-1-yl]-1,2-benzothiazole

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

8019-3429

Molecular Formula

C18H16FN3OS (C18 H16 FN3 OS)

Compound Name

3-[4-(2-fluorobenzoyl)piperazin-1-yl]-1,2-benzothiazole

IUPAC name

3-[4-(2-fluorobenzoyl)piperazin-1-yl]-12-benzothiazole

SMILES

O=C(c(cccc1)c1F)N(CC1)CCN1c1nsc2c1cccc2

InChI

InChI=1S/C18H16FN3OS/c19-15-7-3-1-5-13(15)18(23)22-11-9-21(10-12-22)17-14-6-2-4-8-16(14)24-20-17/h1-8H,9-12H2

InChI Key

GWBMGVCMJIOAIL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09064391

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

341.41

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.855

Distribution Coefficient, logD

3.855

Water Solubility, LogSw

-4.11

Polar Surface Area

30.300

Acid Dissociation Constant (pKa)

24.32

Base Dissociation Constant (pKb)

7.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

8019-3429 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 8019-3429 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-3429?
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What is the minimum amount of 8019-3429 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-3429
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-3429
  • 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 8019-3429 available by request