1683-6352 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-4-nitrobenzamide

1683-6352 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-4-nitrobenzamide
1683-6352 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-4-nitrobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1683-6352
N-(2H-1,3-benzodioxol-5-yl)-4-nitrobenzamide

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

1683-6352

Molecular Formula

C14H10N2O5 (C14 H10 N2 O5)

Compound Name

N-(2H-1,3-benzodioxol-5-yl)-4-nitrobenzamide

IUPAC name

N-(2H-13-benzodioxol-5-yl)-4-nitrobenzamide

SMILES

[O-][N+](c(cc1)ccc1C(Nc(cc1)cc2c1OCO2)=O)=O

InChI

InChI=1S/C14H10N2O5/c17-14(9-1-4-11(5-2-9)16(18)19)15-10-3-6-12-13(7-10)21-8-20-12/h1-7H,8H2,(H,15,17)

InChI Key

LALFACKQVAUKTL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00709744

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

286.24

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.780

Distribution Coefficient, logD

2.778

Water Solubility, LogSw

-3.41

Polar Surface Area

73.827

Acid Dissociation Constant (pKa)

9.74

Base Dissociation Constant (pKb)

-1.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.10

1683-6352 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Frequent Hitters Library (7624 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Structure:
  • Pool
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 1683-6352 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1683-6352?
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What is the minimum amount of 1683-6352 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1683-6352
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1683-6352
  • 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 1683-6352 available by request