2469-0876 Screening compound: 3,5-dibromo-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-iodobenzamide

2469-0876 Screening compound: 3,5-dibromo-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-iodobenzamide
2469-0876 Screening compound: 3,5-dibromo-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-iodobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2469-0876
3,5-dibromo-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-iodobenzamide

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

2469-0876

Molecular Formula

C15H10Br2INO3 (C15 H10 Br2 INO3)

Compound Name

3,5-dibromo-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-iodobenzamide

IUPAC name

35-dibromo-N-(23-dihydro-14-benzodioxin-6-yl)-2-iodobenzamide

SMILES

O=C(c1cc(Br)cc(Br)c1I)Nc(cc1)cc2c1OCCO2

InChI

InChI=1S/C15H10Br2INO3/c16-8-5-10(14(18)11(17)6-8)15(20)19-9-1-2-12-13(7-9)22-4-3-21-12/h1-2,5-7H,3-4H2,(H,19,20)

InChI Key

DVKCZCLFSMUWAS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02084513

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

538.96

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.091

Distribution Coefficient, logD

3.661

Water Solubility, LogSw

-4.32

Polar Surface Area

39.153

Acid Dissociation Constant (pKa)

7.17

Base Dissociation Constant (pKb)

-1.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

References: we are preparing a list of scientific research reports with 2469-0876 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2469-0876?
Check Price and Availability of 2469-0876, 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 2469-0876 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2469-0876
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2469-0876
  • 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 2469-0876 available by request