6415-0888 Screening compound: 4-{6,8-difluoro-3H,3aH,4H,5H,9bH-cyclopenta[c]quinolin-4-yl}pyridine

6415-0888 Screening compound: 4-{6,8-difluoro-3H,3aH,4H,5H,9bH-cyclopenta[c]quinolin-4-yl}pyridine
6415-0888 Screening compound: 4-{6,8-difluoro-3H,3aH,4H,5H,9bH-cyclopenta[c]quinolin-4-yl}pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound 6415-0888
4-{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

6415-0888

Molecular Formula

C17H14F2N2 (C17 H14 F2 N2)

Compound Name

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

IUPAC name

4-[(3aS4R9bR)-68-difluoro-3H3aH4H5H9bH-cyclopenta[c]quinolin-4-yl]pyridine

SMILES

Fc(cc1[C@H]2C=CC[C@@H]22)cc(F)c1N[C@@H]2c1ccncc1

InChI

InChI=1S/C17H14F2N2/c18-11-8-14-12-2-1-3-13(12)16(10-4-6-20-7-5-10)21-17(14)15(19)9-11/h1-2,4-9,12-13,16,21H,3H2/t12-,13+,16-/m1/s1

InChI Key

YCCPMHCEPDQFSF-DVOMOZLQSA-N

MDL Number (MFCD)

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

3.463

Distribution Coefficient, logD

3.458

Water Solubility, LogSw

-3.58

Polar Surface Area

19.498

Acid Dissociation Constant (pKa)

16.17

Base Dissociation Constant (pKb)

5.50

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

23.50

6415-0888 in Drug Discovery

Included in Screening Libraries

3D-Fragment Library (4274 compounds)

3D-Pharmacophore Based Diversity Library (49813 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Fragments
Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 6415-0888 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6415-0888?
Check Price and Availability of 6415-0888, 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 6415-0888 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6415-0888
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6415-0888
  • 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 6415-0888 available by request