7837-0230 Screening compound: 2-{1-[(4-ethoxyphenyl)methyl]-3-oxopiperazin-2-yl}acetic acid

7837-0230 Screening compound: 2-{1-[(4-ethoxyphenyl)methyl]-3-oxopiperazin-2-yl}acetic acid
7837-0230 Screening compound: 2-{1-[(4-ethoxyphenyl)methyl]-3-oxopiperazin-2-yl}acetic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 7837-0230
2-{1-[(4-ethoxyphenyl)methyl]-3-oxopiperazin-2-yl}acetic 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

7837-0230

Molecular Formula

C15H20N2O4 (C15 H20 N2 O4)

Compound Name

2-{1-[(4-ethoxyphenyl)methyl]-3-oxopiperazin-2-yl}acetic acid

IUPAC name

2-{1-[(4-ethoxyphenyl)methyl]-3-oxopiperazin-2-yl}acetic acid

SMILES

CCOc1ccc(CN(CCN2)C(CC(O)=O)C2=O)cc1

InChI

InChI=1S/C15H20N2O4/c1-2-21-12-5-3-11(4-6-12)10-17-8-7-16-15(20)13(17)9-14(18)19/h3-6,13H,2,7-10H2,1H3,(H,16,20)(H,18,19)/t13-/m0/s1

InChI Key

UFAPTAYBYWFFKM-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD05666718

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

292.33

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.302

Distribution Coefficient, logD

-2.647

Water Solubility, LogSw

-1.80

Polar Surface Area

64.194

Acid Dissociation Constant (pKa)

3.69

Base Dissociation Constant (pKb)

6.50

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

46.70

7837-0230 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

CNS Targets (44014 compounds)

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool
Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with 7837-0230 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7837-0230?
Check Price and Availability of 7837-0230, 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 7837-0230 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7837-0230
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7837-0230
  • 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 7837-0230 available by request