D222-0013 Screening compound: 7-methyl-4-({4-[2-(pyridin-4-yl)quinoline-4-carbonyl]piperazin-1-yl}methyl)-2H-chromen-2-one

D222-0013 Screening compound: 7-methyl-4-({4-[2-(pyridin-4-yl)quinoline-4-carbonyl]piperazin-1-yl}methyl)-2H-chromen-2-one
D222-0013 Screening compound: 7-methyl-4-({4-[2-(pyridin-4-yl)quinoline-4-carbonyl]piperazin-1-yl}methyl)-2H-chromen-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D222-0013
7-methyl-4-({4-[2-(pyridin-4-yl)quinoline-4-carbonyl]piperazin-1-yl}methyl)-2H-chromen-2-one

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

D222-0013

Molecular Formula

C30H26N4O3 (C30 H26 N4 O3)

Compound Name

7-methyl-4-({4-[2-(pyridin-4-yl)quinoline-4-carbonyl]piperazin-1-yl}methyl)-2H-chromen-2-one

IUPAC name

7-methyl-4-({4-[2-(pyridin-4-yl)quinoline-4-carbonyl]piperazin-1-yl}methyl)-2H-chromen-2-one

SMILES

Cc(cc1)cc(O2)c1C(CN(CC1)CCN1C(c1cc(-c3ccncc3)nc3ccccc13)=O)=CC2=O

InChI

InChI=1S/C30H26N4O3/c1-20-6-7-23-22(17-29(35)37-28(23)16-20)19-33-12-14-34(15-13-33)30(36)25-18-27(21-8-10-31-11-9-21)32-26-5-3-2-4-24(25)26/h2-11,16-18H,12-15,19H2,1H3

InChI Key

XQSZRQISGOHGNZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08134995

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

490.56

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.040

Distribution Coefficient, logD

4.039

Water Solubility, LogSw

-4.12

Polar Surface Area

58.322

Acid Dissociation Constant (pKa)

28.17

Base Dissociation Constant (pKb)

4.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

D222-0013 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with D222-0013 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D222-0013?
Check Price and Availability of D222-0013, 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 D222-0013 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D222-0013
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D222-0013
  • 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 D222-0013 available by request