8011-7182 Screening compound: 4-(2-bromophenyl)-9-chloro-6-methoxy-3H,3aH,4H,5H,9bH-cyclopenta[c]quinoline

8011-7182 Screening compound: 4-(2-bromophenyl)-9-chloro-6-methoxy-3H,3aH,4H,5H,9bH-cyclopenta[c]quinoline
8011-7182 Screening compound: 4-(2-bromophenyl)-9-chloro-6-methoxy-3H,3aH,4H,5H,9bH-cyclopenta[c]quinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound 8011-7182
4-(2-bromophenyl)-9-chloro-6-methoxy-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

8011-7182

Molecular Formula

C19H17BrClNO (C19 H17 BrClNO)

Compound Name

4-(2-bromophenyl)-9-chloro-6-methoxy-3H,3aH,4H,5H,9bH-cyclopenta[c]quinoline

IUPAC name

(3aS4R9bR)-4-(2-bromophenyl)-9-chloro-6-methoxy-3H3aH4H5H9bH-cyclopenta[c]quinoline

SMILES

COc(ccc(Cl)c1[C@H]2C=CC[C@@H]22)c1N[C@@H]2c(cccc1)c1Br

InChI

InChI=1S/C19H17BrClNO/c1-23-16-10-9-15(21)17-11-6-4-7-12(11)18(22-19(16)17)13-5-2-3-8-14(13)20/h2-6,8-12,18,22H,7H2,1H3/t11-,12-,18+/m1/s1

InChI Key

YNCGFOQAHMGLRL-FMTVUPSXSA-N

MDL Number (MFCD)

MFCD01966769

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.71

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.068

Distribution Coefficient, logD

5.068

Water Solubility, LogSw

-5.47

Polar Surface Area

17.700

Acid Dissociation Constant (pKa)

16.37

Base Dissociation Constant (pKb)

-1.78

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

26.30

8011-7182 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 8011-7182 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8011-7182?
Check Price and Availability of 8011-7182, 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 8011-7182 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8011-7182
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8011-7182
  • 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 8011-7182 available by request