8006-4279 Screening compound: 2-(3-{2-[(2-methoxyphenyl)amino]-1,3-thiazol-4-yl}phenyl)-2,3-dihydro-1H-isoindole-1,3-dione

8006-4279 Screening compound: 2-(3-{2-[(2-methoxyphenyl)amino]-1,3-thiazol-4-yl}phenyl)-2,3-dihydro-1H-isoindole-1,3-dione
8006-4279 Screening compound: 2-(3-{2-[(2-methoxyphenyl)amino]-1,3-thiazol-4-yl}phenyl)-2,3-dihydro-1H-isoindole-1,3-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 8006-4279
2-(3-{2-[(2-methoxyphenyl)amino]-1,3-thiazol-4-yl}phenyl)-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

8006-4279

Molecular Formula

C24H17N3O3S (C24 H17 N3 O3 S)

Compound Name

2-(3-{2-[(2-methoxyphenyl)amino]-1,3-thiazol-4-yl}phenyl)-2,3-dihydro-1H-isoindole-1,3-dione

IUPAC name

2-(3-{2-[(2-methoxyphenyl)amino]-13-thiazol-4-yl}phenyl)-23-dihydro-1H-isoindole-13-dione

SMILES

COc(cccc1)c1Nc1nc(-c2cc(N(C(c3c4cccc3)=O)C4=O)ccc2)cs1

InChI

InChI=1S/C24H17N3O3S/c1-30-21-12-5-4-11-19(21)25-24-26-20(14-31-24)15-7-6-8-16(13-15)27-22(28)17-9-2-3-10-18(17)23(27)29/h2-14H,1H3,(H,25,26)

InChI Key

PIZCFXWPQMZWHG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00785011

Chemical and Physical Properties

Saltdata

HBr

Molecular Weight

427.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.771

Distribution Coefficient, logD

5.771

Water Solubility, LogSw

-5.60

Polar Surface Area

54.500

Acid Dissociation Constant (pKa)

19.22

Base Dissociation Constant (pKb)

3.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.20

8006-4279 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 8006-4279 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8006-4279?
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What is the minimum amount of 8006-4279 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8006-4279
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8006-4279
  • 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 8006-4279 available by request