Y020-8241 Screening compound: 2-(3-oxo-1-{2-[4-(pyrimidin-2-yl)piperazin-1-yl]acetyl}piperazin-2-yl)-N-(4-phenoxyphenyl)acetamide

Y020-8241 Screening compound: 2-(3-oxo-1-{2-[4-(pyrimidin-2-yl)piperazin-1-yl]acetyl}piperazin-2-yl)-N-(4-phenoxyphenyl)acetamide
Y020-8241 Screening compound: 2-(3-oxo-1-{2-[4-(pyrimidin-2-yl)piperazin-1-yl]acetyl}piperazin-2-yl)-N-(4-phenoxyphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-8241
2-(3-oxo-1-{2-[4-(pyrimidin-2-yl)piperazin-1-yl]acetyl}piperazin-2-yl)-N-(4-phenoxyphenyl)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

Y020-8241

Molecular Formula

C28H31N7O4 (C28 H31 N7 O4)

Compound Name

2-(3-oxo-1-{2-[4-(pyrimidin-2-yl)piperazin-1-yl]acetyl}piperazin-2-yl)-N-(4-phenoxyphenyl)acetamide

IUPAC name

2-(3-oxo-1-{2-[4-(pyrimidin-2-yl)piperazin-1-yl]acetyl}piperazin-2-yl)-N-(4-phenoxyphenyl)acetamide

SMILES

O=C(CC(C(NCC1)=O)N1C(CN(CC1)CCN1c1ncccn1)=O)Nc(cc1)ccc1Oc1ccccc1

InChI

InChI=1S/C28H31N7O4/c36-25(32-21-7-9-23(10-8-21)39-22-5-2-1-3-6-22)19-24-27(38)29-13-14-35(24)26(37)20-33-15-17-34(18-16-33)28-30-11-4-12-31-28/h1-12,24H,13-20H2,(H,29,38)(H,32,36)/t24-/m0/s1

InChI Key

VRJVUHUOWCEAGQ-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD09430659

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

529.6

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

2.043

Distribution Coefficient, logD

2.042

Water Solubility, LogSw

-2.69

Polar Surface Area

96.162

Acid Dissociation Constant (pKa)

12.04

Base Dissociation Constant (pKb)

4.76

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

32.10

Y020-8241 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

MCL1 Targeted Library (12200 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with Y020-8241 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-8241?
Check Price and Availability of Y020-8241, 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 Y020-8241 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-8241
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-8241
  • 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 Y020-8241 available by request