8002-5378 Screening compound: 5-bromo-2-(2,4-dinitrobenzamido)phenyl 2,4-dinitrobenzoate

8002-5378 Screening compound: 5-bromo-2-(2,4-dinitrobenzamido)phenyl 2,4-dinitrobenzoate
8002-5378 Screening compound: 5-bromo-2-(2,4-dinitrobenzamido)phenyl 2,4-dinitrobenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8002-5378
5-bromo-2-(2,4-dinitrobenzamido)phenyl 2,4-dinitrobenzoate

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

8002-5378

Molecular Formula

C20H10BrN5O11 (C20 H10 BrN5 O11)

Compound Name

5-bromo-2-(2,4-dinitrobenzamido)phenyl 2,4-dinitrobenzoate

IUPAC name

5-bromo-2-(24-dinitrobenzamido)phenyl 24-dinitrobenzoate

SMILES

[O-][N+](c(cc1)cc([N+]([O-])=O)c1C(Nc(ccc(Br)c1)c1OC(c(ccc([N+]([O-])=O)c1)c1[N+]([O-])=O)=O)=O)=O

InChI

InChI=1S/C20H10BrN5O11/c21-10-1-6-15(22-19(27)13-4-2-11(23(29)30)8-16(13)25(33)34)18(7-10)37-20(28)14-5-3-12(24(31)32)9-17(14)26(35)36/h1-9H,(H,22,27)

InChI Key

ABTZHQYKRZUMPD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00742221

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

576.23

Hydrogen Bond Acceptors Count

21.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

16

Partition Coefficient, logP

4.679

Distribution Coefficient, logD

2.605

Water Solubility, LogSw

-4.77

Polar Surface Area

176.021

Acid Dissociation Constant (pKa)

5.33

Base Dissociation Constant (pKb)

-7.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

References: we are preparing a list of scientific research reports with 8002-5378 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8002-5378?
Check Price and Availability of 8002-5378, 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 8002-5378 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8002-5378
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8002-5378
  • 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 8002-5378 available by request