1959-0123 Screening compound: 4-(4-bromophenyl)-6,9-dimethyl-3H,3aH,4H,5H,9bH-cyclopenta[c]quinoline

1959-0123 Screening compound: 4-(4-bromophenyl)-6,9-dimethyl-3H,3aH,4H,5H,9bH-cyclopenta[c]quinoline
1959-0123 Screening compound: 4-(4-bromophenyl)-6,9-dimethyl-3H,3aH,4H,5H,9bH-cyclopenta[c]quinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound 1959-0123
4-(4-bromophenyl)-6,9-dimethyl-3H,3aH,4H,5H,9bH-cyclopenta[c]quinoline

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

1959-0123

Molecular Formula

C20H20BrN (C20 H20 BrN)

Compound Name

4-(4-bromophenyl)-6,9-dimethyl-3H,3aH,4H,5H,9bH-cyclopenta[c]quinoline

IUPAC name

4-(4-bromophenyl)-69-dimethyl-3H3aH4H5H9bH-cyclopenta[c]quinoline

SMILES

Cc1ccc(C)c2c1C1C=CCC1C(c(cc1)ccc1Br)N2

InChI

InChI=1S/C20H20BrN/c1-12-6-7-13(2)19-18(12)16-4-3-5-17(16)20(22-19)14-8-10-15(21)11-9-14/h3-4,6-11,16-17,20,22H,5H2,1-2H3

InChI Key

NQYZGBCOQMGJFR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01079679

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.29

Hydrogen Bond Acceptors Count

0.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

1

Partition Coefficient, logP

6.144

Distribution Coefficient, logD

6.144

Water Solubility, LogSw

-5.85

Polar Surface Area

10.069

Acid Dissociation Constant (pKa)

16.58

Base Dissociation Constant (pKb)

-1.24

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

30.00

1959-0123 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

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 1959-0123 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1959-0123?
Check Price and Availability of 1959-0123, 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 1959-0123 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1959-0123
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1959-0123
  • 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 1959-0123 available by request