1682-3567 Screening compound: N-benzyl-6-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)hexanamide

1682-3567 Screening compound: N-benzyl-6-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)hexanamide
1682-3567 Screening compound: N-benzyl-6-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)hexanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1682-3567
N-benzyl-6-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)hexanamide

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

1682-3567

Molecular Formula

C21H22N2O3 (C21 H22 N2 O3)

Compound Name

N-benzyl-6-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)hexanamide

IUPAC name

N-benzyl-6-(13-dioxo-23-dihydro-1H-isoindol-2-yl)hexanamide

SMILES

O=C(CCCCCN(C(c1c2cccc1)=O)C2=O)NCc1ccccc1

InChI

InChI=1S/C21H22N2O3/c24-19(22-15-16-9-3-1-4-10-16)13-5-2-8-14-23-20(25)17-11-6-7-12-18(17)21(23)26/h1,3-4,6-7,9-12H,2,5,8,13-15H2,(H,22,24)

InChI Key

UQQACEMHYPVJRF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00266510

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

350.42

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.723

Distribution Coefficient, logD

2.723

Water Solubility, LogSw

-3.38

Polar Surface Area

53.941

Acid Dissociation Constant (pKa)

13.01

Base Dissociation Constant (pKb)

-1.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

1682-3567 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

MCL1 Targeted Library (12200 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic

References: we are preparing a list of scientific research reports with 1682-3567 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1682-3567?
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What is the minimum amount of 1682-3567 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1682-3567
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1682-3567
  • 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 1682-3567 available by request