8157-0293 Screening compound: 2-{1-[(2-chlorophenyl)methyl]-3-oxopiperazin-2-yl}acetic acid

8157-0293 Screening compound: 2-{1-[(2-chlorophenyl)methyl]-3-oxopiperazin-2-yl}acetic acid
8157-0293 Screening compound: 2-{1-[(2-chlorophenyl)methyl]-3-oxopiperazin-2-yl}acetic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 8157-0293
2-{1-[(2-chlorophenyl)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

8157-0293

Molecular Formula

C13H15ClN2O3 (C13 H15 ClN2 O3)

Compound Name

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

IUPAC name

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

SMILES

OC(CC1N(Cc(cccc2)c2Cl)CCNC1=O)=O

InChI

InChI=1S/C13H15ClN2O3/c14-10-4-2-1-3-9(10)8-16-6-5-15-13(19)11(16)7-12(17)18/h1-4,11H,5-8H2,(H,15,19)(H,17,18)/t11-/m0/s1

InChI Key

SPWNROYGRVIXKP-NSHDSACASA-N

MDL Number (MFCD)

MFCD05870481

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

282.73

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

0.551

Distribution Coefficient, logD

-2.399

Water Solubility, LogSw

-2.11

Polar Surface Area

57.071

Acid Dissociation Constant (pKa)

3.69

Base Dissociation Constant (pKb)

6.21

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.50

8157-0293 in Drug Discovery

Included in Screening Libraries

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

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Soluble Diversity Library (15920 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Nervous system
  • Nervous system
  • Cardiovascular
Targets:
  • GPCR
  • Ion Channels
  • Ion Channels

References: we are preparing a list of scientific research reports with 8157-0293 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8157-0293?
Check Price and Availability of 8157-0293, 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 8157-0293 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8157-0293
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8157-0293
  • 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 8157-0293 available by request