7668-0779 Screening compound: 4-{8-chloro-6-methyl-3H,3aH,4H,5H,9bH-cyclopenta[c]quinolin-4-yl}pyridine

7668-0779 Screening compound: 4-{8-chloro-6-methyl-3H,3aH,4H,5H,9bH-cyclopenta[c]quinolin-4-yl}pyridine
7668-0779 Screening compound: 4-{8-chloro-6-methyl-3H,3aH,4H,5H,9bH-cyclopenta[c]quinolin-4-yl}pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound 7668-0779
4-{8-chloro-6-methyl-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

7668-0779

Molecular Formula

C18H17ClN2 (C18 H17 ClN2)

Compound Name

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

IUPAC name

4-[(4S)-8-chloro-6-methyl-3H3aH4H5H9bH-cyclopenta[c]quinolin-4-yl]pyridine

SMILES

Cc1cc(Cl)cc(C2C=CCC22)c1NC2c1ccncc1

InChI

InChI=1S/C18H17ClN2/c1-11-9-13(19)10-16-14-3-2-4-15(14)18(21-17(11)16)12-5-7-20-8-6-12/h2-3,5-10,14-15,18,21H,4H2,1H3/t14?,15?,18-/m0/s1

InChI Key

SQDUIPZNGIDXNR-JMLCCBQJSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

296.8

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

4.318

Distribution Coefficient, logD

4.313

Water Solubility, LogSw

-4.70

Polar Surface Area

19.498

Acid Dissociation Constant (pKa)

16.56

Base Dissociation Constant (pKb)

5.50

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

27.80

7668-0779 in Drug Discovery

Included in Screening Libraries

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

KRAS-Targeted Library (16000 compounds)

Akt-Targeted Library (14764 compounds)

New Agro Library (44492 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 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
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Kinases
  • Kinases
  • Phosphatases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 7668-0779 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7668-0779?
Check Price and Availability of 7668-0779, 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 7668-0779 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7668-0779
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7668-0779
  • 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 7668-0779 available by request