Y042-4622 Screening compound: 5-oxo-5-(3-oxopiperazino)-N~1~-(1,3-thiazol-2-yl)pentanamide

Y042-4622 Screening compound: 5-oxo-5-(3-oxopiperazino)-N~1~-(1,3-thiazol-2-yl)pentanamide
Y042-4622 Screening compound: 5-oxo-5-(3-oxopiperazino)-N~1~-(1,3-thiazol-2-yl)pentanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y042-4622
5-oxo-5-(3-oxopiperazino)-N~1~-(1,3-thiazol-2-yl)pentanamide

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

Y042-4622

Molecular Formula

C12H16N4O3S (C12 H16 N4 O3 S)

Compound Name

5-oxo-5-(3-oxopiperazino)-N~1~-(1,3-thiazol-2-yl)pentanamide

IUPAC name

5-oxo-5-(3-oxopiperazin-1-yl)-N-(13-thiazol-2-yl)pentanamide

SMILES

O=C(CCCC(N(CCN1)CC1=O)=O)Nc1nccs1

InChI

InChI=1S/C12H16N4O3S/c17-9(15-12-14-5-7-20-12)2-1-3-11(19)16-6-4-13-10(18)8-16/h5,7H,1-4,6,8H2,(H,13,18)(H,14,15,17)

InChI Key

ILOBIGYEPVRMLF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD16623741

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

296.35

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

-1.094

Distribution Coefficient, logD

-1.095

Water Solubility, LogSw

-1.64

Polar Surface Area

74.944

Acid Dissociation Constant (pKa)

10.05

Base Dissociation Constant (pKb)

1.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

Y042-4622 in Drug Discovery

Included in Screening Libraries

Arginase Targeted Library (2009 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Male
  • Cardiovascular
Targets:
  • Others

References: we are preparing a list of scientific research reports with Y042-4622 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y042-4622?
Check Price and Availability of Y042-4622, 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 Y042-4622 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y042-4622
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y042-4622
  • 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 Y042-4622 available by request