V003-2733 Screening compound: 1-[2-(4-chlorophenyl)-2-{[4-(trifluoromethyl)phenyl]methoxy}ethyl]-4-(2,5-dimethylfuran-3-carbonyl)piperazine

V003-2733 Screening compound: 1-[2-(4-chlorophenyl)-2-{[4-(trifluoromethyl)phenyl]methoxy}ethyl]-4-(2,5-dimethylfuran-3-carbonyl)piperazine
V003-2733 Screening compound: 1-[2-(4-chlorophenyl)-2-{[4-(trifluoromethyl)phenyl]methoxy}ethyl]-4-(2,5-dimethylfuran-3-carbonyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-2733
1-[2-(4-chlorophenyl)-2-{[4-(trifluoromethyl)phenyl]methoxy}ethyl]-4-(2,5-dimethylfuran-3-carbonyl)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

V003-2733

Molecular Formula

C27H28ClF3N2O3 (C27 H28 ClF3 N2 O3)

Compound Name

1-[2-(4-chlorophenyl)-2-{[4-(trifluoromethyl)phenyl]methoxy}ethyl]-4-(2,5-dimethylfuran-3-carbonyl)piperazine

IUPAC name

1-[2-(4-chlorophenyl)-2-{[4-(trifluoromethyl)phenyl]methoxy}ethyl]-4-(25-dimethylfuran-3-carbonyl)piperazine

SMILES

Cc1cc(C(N2CCN(CC(c(cc3)ccc3Cl)OCc3ccc(C(F)(F)F)cc3)CC2)=O)c(C)o1

InChI

InChI=1S/C27H28ClF3N2O3/c1-18-15-24(19(2)36-18)26(34)33-13-11-32(12-14-33)16-25(21-5-9-23(28)10-6-21)35-17-20-3-7-22(8-4-20)27(29,30)31/h3-10,15,25H,11-14,16-17H2,1-2H3/t25-/m0/s1

InChI Key

GMVHTOFYFBEZAA-VWLOTQADSA-N

MDL Number (MFCD)

MFCD19954732

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

520.98

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.313

Distribution Coefficient, logD

5.311

Water Solubility, LogSw

-5.93

Polar Surface Area

35.055

Acid Dissociation Constant (pKa)

23.09

Base Dissociation Constant (pKb)

5.20

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.00

V003-2733 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V003-2733 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-2733?
Check Price and Availability of V003-2733, 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 V003-2733 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-2733
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-2733
  • 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 V003-2733 available by request