V030-7083 Screening compound: 1-(4-methoxybenzoyl)-4-({5-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-3-yl}methyl)piperazine

V030-7083 Screening compound: 1-(4-methoxybenzoyl)-4-({5-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-3-yl}methyl)piperazine
V030-7083 Screening compound: 1-(4-methoxybenzoyl)-4-({5-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-3-yl}methyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-7083
1-(4-methoxybenzoyl)-4-({5-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-3-yl}methyl)piperazine

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

V030-7083

Molecular Formula

C22H21F3N4O3 (C22 H21 F3 N4 O3)

Compound Name

1-(4-methoxybenzoyl)-4-({5-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-3-yl}methyl)piperazine

IUPAC name

1-(4-methoxybenzoyl)-4-({5-[4-(trifluoromethyl)phenyl]-124-oxadiazol-3-yl}methyl)piperazine

SMILES

COc(cc1)ccc1C(N1CCN(Cc2noc(-c3ccc(C(F)(F)F)cc3)n2)CC1)=O

InChI

InChI=1S/C22H21F3N4O3/c1-31-18-8-4-16(5-9-18)21(30)29-12-10-28(11-13-29)14-19-26-20(32-27-19)15-2-6-17(7-3-15)22(23,24)25/h2-9H,10-14H2,1H3

InChI Key

XCBCJKKZXNTTQE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14286558

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

446.43

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.340

Distribution Coefficient, logD

3.340

Water Solubility, LogSw

-3.34

Polar Surface Area

60.639

Acid Dissociation Constant (pKa)

28.54

Base Dissociation Constant (pKb)

2.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

V030-7083 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • 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 V030-7083 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-7083?
Check Price and Availability of V030-7083, 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 V030-7083 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-7083
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-7083
  • 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 V030-7083 available by request