Y206-5657 Screening compound: N~4~-(1,3-benzodioxol-5-yl)-2-(3-methoxyphenyl)-4-quinolinecarboxamide

Y206-5657 Screening compound: N~4~-(1,3-benzodioxol-5-yl)-2-(3-methoxyphenyl)-4-quinolinecarboxamide
Y206-5657 Screening compound: N~4~-(1,3-benzodioxol-5-yl)-2-(3-methoxyphenyl)-4-quinolinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y206-5657
N~4~-(1,3-benzodioxol-5-yl)-2-(3-methoxyphenyl)-4-quinolinecarboxamide

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

Y206-5657

Molecular Formula

C24H18N2O4 (C24 H18 N2 O4)

Compound Name

N~4~-(1,3-benzodioxol-5-yl)-2-(3-methoxyphenyl)-4-quinolinecarboxamide

IUPAC name

N-(2H-13-benzodioxol-5-yl)-2-(3-methoxyphenyl)quinoline-4-carboxamide

SMILES

COc1cccc(-c2nc3ccccc3c(C(Nc(cc3)cc4c3OCO4)=O)c2)c1

InChI

InChI=1S/C24H18N2O4/c1-28-17-6-4-5-15(11-17)21-13-19(18-7-2-3-8-20(18)26-21)24(27)25-16-9-10-22-23(12-16)30-14-29-22/h2-13H,14H2,1H3,(H,25,27)

InChI Key

NPOARAITXRJURG-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.42

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.327

Distribution Coefficient, logD

5.327

Water Solubility, LogSw

-5.66

Polar Surface Area

56.048

Acid Dissociation Constant (pKa)

11.61

Base Dissociation Constant (pKb)

3.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.33

References: we are preparing a list of scientific research reports with Y206-5657 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y206-5657?
Check Price and Availability of Y206-5657, 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 Y206-5657 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y206-5657
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y206-5657
  • 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 Y206-5657 available by request