8019-8539 Screening compound: 5-fluoro-2-(piperidin-3-yl)-1H-1,3-benzodiazole

8019-8539 Screening compound: 5-fluoro-2-(piperidin-3-yl)-1H-1,3-benzodiazole
8019-8539 Screening compound: 5-fluoro-2-(piperidin-3-yl)-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-8539
5-fluoro-2-(piperidin-3-yl)-1H-1,3-benzodiazole

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

8019-8539

Molecular Formula

C12H14FN3 (C12 H14 FN3)

Compound Name

5-fluoro-2-(piperidin-3-yl)-1H-1,3-benzodiazole

IUPAC name

5-fluoro-2-(piperidin-3-yl)-1H-13-benzodiazole

SMILES

Fc(cc1)cc2c1[nH]c(C1CNCCC1)n2

InChI

InChI=1S/C12H14FN3/c13-9-3-4-10-11(6-9)16-12(15-10)8-2-1-5-14-7-8/h3-4,6,8,14H,1-2,5,7H2,(H,15,16)/t8-/m0/s1

InChI Key

HSGAEPTYDKJILR-QMMMGPOBSA-N

MDL Number (MFCD)

MFCD06739000

Chemical and Physical Properties

Saltdata

2HCl

Molecular Weight

219.26

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

1.202

Distribution Coefficient, logD

-1.191

Water Solubility, LogSw

-1.29

Polar Surface Area

31.342

Acid Dissociation Constant (pKa)

10.55

Base Dissociation Constant (pKb)

9.79

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

41.67

8019-8539 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Soluble Diversity Library (15920 compounds)

Ion Channels Focused Library (26372 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 8019-8539 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-8539?
Check Price and Availability of 8019-8539, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 8019-8539 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-8539
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-8539
  • 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 8019-8539 available by request