1683-6964 Screening compound: 3-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)-N-(3-hydroxyphenyl)propanamide

1683-6964 Screening compound: 3-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)-N-(3-hydroxyphenyl)propanamide
1683-6964 Screening compound: 3-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)-N-(3-hydroxyphenyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1683-6964
3-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)-N-(3-hydroxyphenyl)propanamide

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

1683-6964

Molecular Formula

C17H14N2O4 (C17 H14 N2 O4)

Compound Name

3-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)-N-(3-hydroxyphenyl)propanamide

IUPAC name

3-(13-dioxo-23-dihydro-1H-isoindol-2-yl)-N-(3-hydroxyphenyl)propanamide

SMILES

Oc1cccc(NC(CCN(C(c2c3cccc2)=O)C3=O)=O)c1

InChI

InChI=1S/C17H14N2O4/c20-12-5-3-4-11(10-12)18-15(21)8-9-19-16(22)13-6-1-2-7-14(13)17(19)23/h1-7,10,20H,8-9H2,(H,18,21)

InChI Key

SJNINDHIZXONAE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00708110

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

310.31

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.649

Distribution Coefficient, logD

1.642

Water Solubility, LogSw

-2.30

Polar Surface Area

70.236

Acid Dissociation Constant (pKa)

9.19

Base Dissociation Constant (pKb)

-0.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

1683-6964 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

NOTUM (Wnt signaling) Library (3881 compounds)

Carbonic Anhydrase II Library (4939 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1683-6964 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1683-6964?
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What is the minimum amount of 1683-6964 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1683-6964
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1683-6964
  • 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 1683-6964 available by request