0167-0014 Screening compound: 4-(4-methylpiperazin-1-yl)-4-oxobutanoic acid

0167-0014 Screening compound: 4-(4-methylpiperazin-1-yl)-4-oxobutanoic acid
0167-0014 Screening compound: 4-(4-methylpiperazin-1-yl)-4-oxobutanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 0167-0014
4-(4-methylpiperazin-1-yl)-4-oxobutanoic acid

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

0167-0014

Molecular Formula

C9H16N2O3 (C9 H16 N2 O3)

Compound Name

4-(4-methylpiperazin-1-yl)-4-oxobutanoic acid

IUPAC name

4-(4-methylpiperazin-1-yl)-4-oxobutanoic acid

SMILES

CN(CC1)CCN1C(CCC(O)=O)=O

InChI

InChI=1S/C9H16N2O3/c1-10-4-6-11(7-5-10)8(12)2-3-9(13)14/h2-7H2,1H3,(H,13,14)

InChI Key

NZTQZEIZMMJXFG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00463560

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

200.24

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

-1.099

Distribution Coefficient, logD

-4.049

Water Solubility, LogSw

0.01

Polar Surface Area

48.491

Acid Dissociation Constant (pKa)

4.45

Base Dissociation Constant (pKb)

7.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

77.80

0167-0014 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

CNS Targets (44014 compounds)

Dark Chemical Matter Library (18430 compounds)

Fragments Library (11262 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Structure:
  • Pool
  • Fragments

References: we are preparing a list of scientific research reports with 0167-0014 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0167-0014?
Check Price and Availability of 0167-0014, 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 0167-0014 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0167-0014
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0167-0014
  • 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 0167-0014 available by request