Y200-0652 Screening compound: methyl 4-[2-(pyridin-2-yl)quinoline-4-amido]benzoate

Y200-0652 Screening compound: methyl 4-[2-(pyridin-2-yl)quinoline-4-amido]benzoate
Y200-0652 Screening compound: methyl 4-[2-(pyridin-2-yl)quinoline-4-amido]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y200-0652
methyl 4-[2-(pyridin-2-yl)quinoline-4-amido]benzoate

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

Y200-0652

Molecular Formula

C23H17N3O3 (C23 H17 N3 O3)

Compound Name

methyl 4-[2-(pyridin-2-yl)quinoline-4-amido]benzoate

IUPAC name

methyl 4-[2-(pyridin-2-yl)quinoline-4-amido]benzoate

SMILES

COC(c(cc1)ccc1NC(c1cc(-c2ncccc2)nc2ccccc12)=O)=O

InChI

InChI=1S/C23H17N3O3/c1-29-23(28)15-9-11-16(12-10-15)25-22(27)18-14-21(20-8-4-5-13-24-20)26-19-7-3-2-6-17(18)19/h2-14H,1H3,(H,25,27)

InChI Key

VFQDDYXCRYCRRK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05999476

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

383.41

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.387

Distribution Coefficient, logD

4.387

Water Solubility, LogSw

-4.39

Polar Surface Area

61.610

Acid Dissociation Constant (pKa)

11.13

Base Dissociation Constant (pKb)

3.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.30

Y200-0652 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

SH2 Library (10483 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Endocrine
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with Y200-0652 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y200-0652?
Check Price and Availability of Y200-0652, 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 Y200-0652 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y200-0652
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y200-0652
  • 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 Y200-0652 available by request