1190-0117 Screening compound: N-[9,10-dioxo-4-(phenylamino)-9,10-dihydroanthracen-1-yl]acetamide

1190-0117 Screening compound: N-[9,10-dioxo-4-(phenylamino)-9,10-dihydroanthracen-1-yl]acetamide
1190-0117 Screening compound: N-[9,10-dioxo-4-(phenylamino)-9,10-dihydroanthracen-1-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1190-0117
N-[9,10-dioxo-4-(phenylamino)-9,10-dihydroanthracen-1-yl]acetamide

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

1190-0117

Molecular Formula

C22H16N2O3 (C22 H16 N2 O3)

Compound Name

N-[9,10-dioxo-4-(phenylamino)-9,10-dihydroanthracen-1-yl]acetamide

IUPAC name

N-[910-dioxo-4-(phenylamino)-910-dihydroanthracen-1-yl]acetamide

SMILES

CC(Nc(c(C(c1c2cccc1)=O)c1C2=O)ccc1Nc1ccccc1)=O

InChI

InChI=1S/C22H16N2O3/c1-13(25)23-17-11-12-18(24-14-7-3-2-4-8-14)20-19(17)21(26)15-9-5-6-10-16(15)22(20)27/h2-12,24H,1H3,(H,23,25)

InChI Key

NZNQCFRVZSFFAG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00845843

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

356.38

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.188

Distribution Coefficient, logD

4.188

Water Solubility, LogSw

-4.56

Polar Surface Area

56.959

Acid Dissociation Constant (pKa)

10.58

Base Dissociation Constant (pKb)

-4.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.50

1190-0117 in Drug Discovery

Included in Screening Libraries

Eccentric PPI Library (11937 compounds)

Frequent Hitters Library (7624 compounds)

Nucleic Acid Ligands (8311 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
  • Pool
Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system

References: we are preparing a list of scientific research reports with 1190-0117 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1190-0117?
Check Price and Availability of 1190-0117, 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 1190-0117 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1190-0117
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1190-0117
  • 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 1190-0117 available by request