4170-0361 Screening compound: N-(9,10-dioxo-9,10-dihydroanthracen-2-yl)-3-methoxybenzamide

4170-0361 Screening compound: N-(9,10-dioxo-9,10-dihydroanthracen-2-yl)-3-methoxybenzamide
4170-0361 Screening compound: N-(9,10-dioxo-9,10-dihydroanthracen-2-yl)-3-methoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4170-0361
N-(9,10-dioxo-9,10-dihydroanthracen-2-yl)-3-methoxybenzamide

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

4170-0361

Molecular Formula

C22H15NO4 (C22 H15 NO4)

Compound Name

N-(9,10-dioxo-9,10-dihydroanthracen-2-yl)-3-methoxybenzamide

IUPAC name

N-(910-dioxo-910-dihydroanthracen-2-yl)-3-methoxybenzamide

SMILES

COc1cccc(C(Nc(cc2)cc(C(c3c4cccc3)=O)c2C4=O)=O)c1

InChI

InChI=1S/C22H15NO4/c1-27-15-6-4-5-13(11-15)22(26)23-14-9-10-18-19(12-14)21(25)17-8-3-2-7-16(17)20(18)24/h2-12H,1H3,(H,23,26)

InChI Key

NEPUZNUSGOMFAN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14709543

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

357.37

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.560

Distribution Coefficient, logD

4.554

Water Solubility, LogSw

-4.59

Polar Surface Area

56.815

Acid Dissociation Constant (pKa)

9.22

Base Dissociation Constant (pKb)

-7.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.50

4170-0361 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Antiviral Annotated Library (21441 compounds)

Human Receptors Annotated Library (5376 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 4170-0361 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4170-0361?
Check Price and Availability of 4170-0361, 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 4170-0361 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4170-0361
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4170-0361
  • 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 4170-0361 available by request