D676-1297 Screening compound: 2-methoxy-5-(4-{[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl}piperazine-1-carbonyl)benzonitrile

D676-1297 Screening compound: 2-methoxy-5-(4-{[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl}piperazine-1-carbonyl)benzonitrile
D676-1297 Screening compound: 2-methoxy-5-(4-{[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl}piperazine-1-carbonyl)benzonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound D676-1297
2-methoxy-5-(4-{[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl}piperazine-1-carbonyl)benzonitrile

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

D676-1297

Molecular Formula

C23H23N5O3 (C23 H23 N5 O3)

Compound Name

2-methoxy-5-(4-{[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl}piperazine-1-carbonyl)benzonitrile

IUPAC name

2-methoxy-5-(4-{[5-(4-methylphenyl)-124-oxadiazol-3-yl]methyl}piperazine-1-carbonyl)benzonitrile

SMILES

Cc(cc1)ccc1-c1nc(CN(CC2)CCN2C(c(cc2)cc(C#N)c2OC)=O)no1

InChI

InChI=1S/C23H23N5O3/c1-16-3-5-17(6-4-16)22-25-21(26-31-22)15-27-9-11-28(12-10-27)23(29)18-7-8-20(30-2)19(13-18)14-24/h3-8,13H,9-12,15H2,1-2H3

InChI Key

RUUTXARVSPGUJX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27595715

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

417.47

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.431

Distribution Coefficient, logD

2.431

Water Solubility, LogSw

-2.90

Polar Surface Area

77.782

Acid Dissociation Constant (pKa)

28.37

Base Dissociation Constant (pKb)

2.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

D676-1297 in Drug Discovery

Included in Screening Libraries

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
  • Ion Channels
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with D676-1297 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D676-1297?
Check Price and Availability of D676-1297, 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 D676-1297 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D676-1297
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D676-1297
  • 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 D676-1297 available by request