8003-9456 Screening compound: N1,N3-bis(2-bromo-4-nitrophenyl)benzene-1,3-dicarboxamide

8003-9456 Screening compound: N1,N3-bis(2-bromo-4-nitrophenyl)benzene-1,3-dicarboxamide
8003-9456 Screening compound: N1,N3-bis(2-bromo-4-nitrophenyl)benzene-1,3-dicarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8003-9456
N1,N3-bis(2-bromo-4-nitrophenyl)benzene-1,3-dicarboxamide

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

8003-9456

Molecular Formula

C20H12Br2N4O6 (C20 H12 Br2 N4 O6)

Compound Name

N1,N3-bis(2-bromo-4-nitrophenyl)benzene-1,3-dicarboxamide

IUPAC name

N1N3-bis(2-bromo-4-nitrophenyl)benzene-13-dicarboxamide

SMILES

[O-][N+](c(cc1)cc(Br)c1NC(c1cccc(C(Nc(ccc([N+]([O-])=O)c2)c2Br)=O)c1)=O)=O

InChI

InChI=1S/C20H12Br2N4O6/c21-15-9-13(25(29)30)4-6-17(15)23-19(27)11-2-1-3-12(8-11)20(28)24-18-7-5-14(26(31)32)10-16(18)22/h1-10H,(H,23,27)(H,24,28)

InChI Key

DXRXHXVAJCEJNE-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

564.15

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

5.402

Distribution Coefficient, logD

4.344

Water Solubility, LogSw

-5.80

Polar Surface Area

111.788

Acid Dissociation Constant (pKa)

6.38

Base Dissociation Constant (pKb)

-7.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

References: we are preparing a list of scientific research reports with 8003-9456 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8003-9456?
Check Price and Availability of 8003-9456, 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 8003-9456 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8003-9456
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8003-9456
  • 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 8003-9456 available by request