8014-2733 Screening compound: 1-(3-bromobenzyl)-3-nitro-2(1H)-pyridinone

8014-2733 Screening compound: 1-(3-bromobenzyl)-3-nitro-2(1H)-pyridinone
8014-2733 Screening compound: 1-(3-bromobenzyl)-3-nitro-2(1H)-pyridinone alternative view

Chemical Structure Depiction of ChemDiv screening compound 8014-2733
1-(3-bromobenzyl)-3-nitro-2(1H)-pyridinone

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

8014-2733

Molecular Formula

C12H9BrN2O3 (C12 H9 BrN2 O3)

Compound Name

1-(3-bromobenzyl)-3-nitro-2(1H)-pyridinone

IUPAC name

1-[(3-bromophenyl)methyl]-3-nitro-12-dihydropyridin-2-one

SMILES

[O-][N+](C1=CC=CN(Cc2cccc(Br)c2)C1=O)=O

InChI

InChI=1S/C12H9BrN2O3/c13-10-4-1-3-9(7-10)8-14-6-2-5-11(12(14)16)15(17)18/h1-7H,8H2

InChI Key

UEVQNHCCIZLULM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03768617

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

309.12

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.368

Distribution Coefficient, logD

2.368

Water Solubility, LogSw

-2.64

Polar Surface Area

49.061

Acid Dissociation Constant (pKa)

30.24

Base Dissociation Constant (pKb)

-7.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.33

8014-2733 in Drug Discovery

Included in Screening Libraries

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 8014-2733 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8014-2733?
Check Price and Availability of 8014-2733, 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 8014-2733 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8014-2733
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8014-2733
  • 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 8014-2733 available by request