Y509-0477 Screening compound: 2-(1,3-benzodioxol-5-yl)-N~4~-(3,4-dichlorobenzyl)-4-quinolinecarboxamide

Y509-0477 Screening compound: 2-(1,3-benzodioxol-5-yl)-N~4~-(3,4-dichlorobenzyl)-4-quinolinecarboxamide
Y509-0477 Screening compound: 2-(1,3-benzodioxol-5-yl)-N~4~-(3,4-dichlorobenzyl)-4-quinolinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y509-0477
2-(1,3-benzodioxol-5-yl)-N~4~-(3,4-dichlorobenzyl)-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

Y509-0477

Molecular Formula

C24H16Cl2N2O3 (C24 H16 Cl2 N2 O3)

Compound Name

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

IUPAC name

n/a

SMILES

O=C(c1cc(-c(cc2)cc3c2OCO3)nc2ccccc12)NCc(cc1)cc(Cl)c1Cl

InChI

InChI=1S/C24H16Cl2N2O3/c25-18-7-5-14(9-19(18)26)12-27-24(29)17-11-21(28-20-4-2-1-3-16(17)20)15-6-8-22-23(10-15)31-13-30-22/h1-11H,12-13H2,(H,27,29)

InChI Key

FBPYIWDTXICWSX-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

451.31

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.677

Distribution Coefficient, logD

6.676

Water Solubility, LogSw

-6.49

Polar Surface Area

49.826

Acid Dissociation Constant (pKa)

12.98

Base Dissociation Constant (pKb)

4.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

References: we are preparing a list of scientific research reports with Y509-0477 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y509-0477?
Check Price and Availability of Y509-0477, 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 Y509-0477 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y509-0477
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y509-0477
  • 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 Y509-0477 available by request