J038-2692 Screening compound: 4-(4-bromophenyl)-8-methyl-2H,3H,3aH,4H,5H,9bH-furo[3,2-c]quinoline

J038-2692 Screening compound: 4-(4-bromophenyl)-8-methyl-2H,3H,3aH,4H,5H,9bH-furo[3,2-c]quinoline
J038-2692 Screening compound: 4-(4-bromophenyl)-8-methyl-2H,3H,3aH,4H,5H,9bH-furo[3,2-c]quinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound J038-2692
4-(4-bromophenyl)-8-methyl-2H,3H,3aH,4H,5H,9bH-furo[3,2-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

J038-2692

Molecular Formula

C18H18BrNO (C18 H18 BrNO)

Compound Name

4-(4-bromophenyl)-8-methyl-2H,3H,3aH,4H,5H,9bH-furo[3,2-c]quinoline

IUPAC name

(3aS9bS)-4-(4-bromophenyl)-8-methyl-2H3H3aH4H5H9bH-furo[32-c]quinoline

SMILES

Cc(cc1)cc([C@H]2OCC[C@@H]22)c1NC2c(cc1)ccc1Br

InChI

InChI=1S/C18H18BrNO/c1-11-2-7-16-15(10-11)18-14(8-9-21-18)17(20-16)12-3-5-13(19)6-4-12/h2-7,10,14,17-18,20H,8-9H2,1H3/t14-,17?,18+/m0/s1

InChI Key

CXVIDGGMNLBIKW-HXFVUSARSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

344.25

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

4.806

Distribution Coefficient, logD

4.806

Water Solubility, LogSw

-4.63

Polar Surface Area

21.196

Acid Dissociation Constant (pKa)

18.21

Base Dissociation Constant (pKb)

4.99

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

33.30

J038-2692 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

3D-Pharmacophore Based Diversity Library (49813 compounds)

KRAS-Targeted Library (16000 compounds)

Akt-Targeted Library (14764 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
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 J038-2692 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J038-2692?
Check Price and Availability of J038-2692, 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 J038-2692 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J038-2692
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J038-2692
  • 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 J038-2692 available by request