8002-5166 Screening compound: 2-(2-methylphenyl)-N-(4-methylphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxamide

8002-5166 Screening compound: 2-(2-methylphenyl)-N-(4-methylphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxamide
8002-5166 Screening compound: 2-(2-methylphenyl)-N-(4-methylphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8002-5166
2-(2-methylphenyl)-N-(4-methylphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxamide

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

8002-5166

Molecular Formula

C23H18N2O3 (C23 H18 N2 O3)

Compound Name

2-(2-methylphenyl)-N-(4-methylphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxamide

IUPAC name

2-(2-methylphenyl)-N-(4-methylphenyl)-13-dioxo-23-dihydro-1H-isoindole-5-carboxamide

SMILES

Cc(cc1)ccc1NC(c(cc1)cc(C(N2c3c(C)cccc3)=O)c1C2=O)=O

InChI

InChI=1S/C23H18N2O3/c1-14-7-10-17(11-8-14)24-21(26)16-9-12-18-19(13-16)23(28)25(22(18)27)20-6-4-3-5-15(20)2/h3-13H,1-2H3,(H,24,26)

InChI Key

RWVVURMJTZWHKJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00732804

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

370.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.665

Distribution Coefficient, logD

4.664

Water Solubility, LogSw

-4.40

Polar Surface Area

51.670

Acid Dissociation Constant (pKa)

10.04

Base Dissociation Constant (pKb)

-2.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.70

8002-5166 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Cardiovascular

References: we are preparing a list of scientific research reports with 8002-5166 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8002-5166?
Check Price and Availability of 8002-5166, 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 8002-5166 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8002-5166
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8002-5166
  • 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 8002-5166 available by request