6415-1038 Screening compound: 3-{6,8-difluoro-3H,3aH,4H,5H,9bH-cyclopenta[c]quinolin-4-yl}pyridine

6415-1038 Screening compound: 3-{6,8-difluoro-3H,3aH,4H,5H,9bH-cyclopenta[c]quinolin-4-yl}pyridine
6415-1038 Screening compound: 3-{6,8-difluoro-3H,3aH,4H,5H,9bH-cyclopenta[c]quinolin-4-yl}pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound 6415-1038
3-{6,8-difluoro-3H,3aH,4H,5H,9bH-cyclopenta[c]quinolin-4-yl}pyridine

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

6415-1038

Molecular Formula

C17H14F2N2 (C17 H14 F2 N2)

Compound Name

3-{6,8-difluoro-3H,3aH,4H,5H,9bH-cyclopenta[c]quinolin-4-yl}pyridine

IUPAC name

3-{68-difluoro-3H3aH4H5H9bH-cyclopenta[c]quinolin-4-yl}pyridine

SMILES

Fc(cc1C2C=CCC22)cc(F)c1NC2c1cnccc1

InChI

InChI=1S/C17H14F2N2/c18-11-7-14-12-4-1-5-13(12)16(10-3-2-6-20-9-10)21-17(14)15(19)8-11/h1-4,6-9,12-13,16,21H,5H2

InChI Key

NJZHEQOUHLZCOX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27937048

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

284.31

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

3.427

Distribution Coefficient, logD

3.427

Water Solubility, LogSw

-3.40

Polar Surface Area

19.587

Acid Dissociation Constant (pKa)

16.57

Base Dissociation Constant (pKb)

3.31

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

23.50

6415-1038 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)

Akt-Targeted Library (14764 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 6415-1038 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6415-1038?
Check Price and Availability of 6415-1038, 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 6415-1038 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6415-1038
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6415-1038
  • 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 6415-1038 available by request