3454-0429 Screening compound: 2-(6-methylpyridin-2-yl)-4-nitro-2,3-dihydro-1H-isoindole-1,3-dione

3454-0429 Screening compound: 2-(6-methylpyridin-2-yl)-4-nitro-2,3-dihydro-1H-isoindole-1,3-dione
3454-0429 Screening compound: 2-(6-methylpyridin-2-yl)-4-nitro-2,3-dihydro-1H-isoindole-1,3-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 3454-0429
2-(6-methylpyridin-2-yl)-4-nitro-2,3-dihydro-1H-isoindole-1,3-dione

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

3454-0429

Molecular Formula

C14H9N3O4 (C14 H9 N3 O4)

Compound Name

2-(6-methylpyridin-2-yl)-4-nitro-2,3-dihydro-1H-isoindole-1,3-dione

IUPAC name

2-(6-methylpyridin-2-yl)-4-nitro-23-dihydro-1H-isoindole-13-dione

SMILES

Cc1cccc(N(C(c2cccc([N+]([O-])=O)c22)=O)C2=O)n1

InChI

InChI=1S/C14H9N3O4/c1-8-4-2-7-11(15-8)16-13(18)9-5-3-6-10(17(20)21)12(9)14(16)19/h2-7H,1H3

InChI Key

OCVHWGRZTWOHBY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00574177

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

283.24

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.601

Distribution Coefficient, logD

1.601

Water Solubility, LogSw

-2.17

Polar Surface Area

69.846

Acid Dissociation Constant (pKa)

30.05

Base Dissociation Constant (pKb)

-1.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.10

References: we are preparing a list of scientific research reports with 3454-0429 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3454-0429?
Check Price and Availability of 3454-0429, 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 3454-0429 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3454-0429
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3454-0429
  • 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 3454-0429 available by request