0865-0039 Screening compound: 1'-methyl-[2,3'-biquinolin]-1'-ium

0865-0039 Screening compound: 1'-methyl-[2,3'-biquinolin]-1'-ium
0865-0039 Screening compound: 1'-methyl-[2,3'-biquinolin]-1'-ium alternative view

Chemical Structure Depiction of ChemDiv screening compound 0865-0039
1'-methyl-[2,3'-biquinolin]-1'-ium

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

0865-0039

Molecular Formula

C19H15N2 (C19 H15 N2)

Compound Name

1'-methyl-[2,3'-biquinolin]-1'-ium

IUPAC name

1'-methyl-[23'-biquinolin]-1'-ium

SMILES

C[n+]1cc(-c2nc3ccccc3cc2)cc2ccccc12

InChI

InChI=1S/C19H15N2/c1-21-13-16(12-15-7-3-5-9-19(15)21)18-11-10-14-6-2-4-8-17(14)20-18/h2-13H,1H3/q+1

InChI Key

WBGOZXFMJLDJFS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01366007

Chemical and Physical Properties

Saltdata

I-

Molecular Weight

271.34

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

4.436

Distribution Coefficient, logD

4.434

Water Solubility, LogSw

-4.62

Polar Surface Area

9.839

Acid Dissociation Constant (pKa)

28.47

Base Dissociation Constant (pKb)

5.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.30

0865-0039 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 0865-0039 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0865-0039?
Check Price and Availability of 0865-0039, 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 0865-0039 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0865-0039
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0865-0039
  • 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 0865-0039 available by request