0136-0238 Screening compound: 6-bromo-N-{3-chloro-4-[(4-chloronaphthalen-1-yl)oxy]phenyl}quinolin-4-amine

0136-0238 Screening compound: 6-bromo-N-{3-chloro-4-[(4-chloronaphthalen-1-yl)oxy]phenyl}quinolin-4-amine
0136-0238 Screening compound: 6-bromo-N-{3-chloro-4-[(4-chloronaphthalen-1-yl)oxy]phenyl}quinolin-4-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 0136-0238
6-bromo-N-{3-chloro-4-[(4-chloronaphthalen-1-yl)oxy]phenyl}quinolin-4-amine

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

0136-0238

Molecular Formula

C25H15BrCl2N2O (C25 H15 BrCl2 N2 O)

Compound Name

6-bromo-N-{3-chloro-4-[(4-chloronaphthalen-1-yl)oxy]phenyl}quinolin-4-amine

IUPAC name

6-bromo-N-{3-chloro-4-[(4-chloronaphthalen-1-yl)oxy]phenyl}quinolin-4-amine

SMILES

Clc(c1ccccc11)ccc1Oc(ccc(Nc1c(cc(cc2)Br)c2ncc1)c1)c1Cl

InChI

InChI=1S/C25H15BrCl2N2O/c26-15-5-8-22-19(13-15)23(11-12-29-22)30-16-6-9-25(21(28)14-16)31-24-10-7-20(27)17-3-1-2-4-18(17)24/h1-14H,(H,29,30)

InChI Key

IJHAUSBPVGGBGQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00681268

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

510.22

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

8.840

Distribution Coefficient, logD

8.722

Water Solubility, LogSw

-7.00

Polar Surface Area

23.865

Acid Dissociation Constant (pKa)

17.68

Base Dissociation Constant (pKb)

6.89

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

0136-0238 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with 0136-0238 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0136-0238?
Check Price and Availability of 0136-0238, 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 0136-0238 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0136-0238
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0136-0238
  • 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 0136-0238 available by request