1959-0301 Screening compound: 4-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)-N-(3-acetamidophenyl)benzamide

1959-0301 Screening compound: 4-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)-N-(3-acetamidophenyl)benzamide
1959-0301 Screening compound: 4-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)-N-(3-acetamidophenyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1959-0301
4-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)-N-(3-acetamidophenyl)benzamide

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

1959-0301

Molecular Formula

C23H17N3O4 (C23 H17 N3 O4)

Compound Name

4-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)-N-(3-acetamidophenyl)benzamide

IUPAC name

4-(13-dioxo-23-dihydro-1H-isoindol-2-yl)-N-(3-acetamidophenyl)benzamide

SMILES

CC(Nc1cccc(NC(c(cc2)ccc2N(C(c2c3cccc2)=O)C3=O)=O)c1)=O

InChI

InChI=1S/C23H17N3O4/c1-14(27)24-16-5-4-6-17(13-16)25-21(28)15-9-11-18(12-10-15)26-22(29)19-7-2-3-8-20(19)23(26)30/h2-13H,1H3,(H,24,27)(H,25,28)

InChI Key

OVTQMRVQZLEQFK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00586634

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.41

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.707

Distribution Coefficient, logD

2.707

Water Solubility, LogSw

-3.54

Polar Surface Area

75.233

Acid Dissociation Constant (pKa)

11.60

Base Dissociation Constant (pKb)

0.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.30

1959-0301 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with 1959-0301 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1959-0301?
Check Price and Availability of 1959-0301, 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 1959-0301 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1959-0301
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1959-0301
  • 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 1959-0301 available by request