V008-0301 Screening compound: 1-[3-(2-chloro-4-fluorophenoxy)-3-(2-fluorophenyl)propyl]-4-(2-methoxyphenyl)piperazine

V008-0301 Screening compound: 1-[3-(2-chloro-4-fluorophenoxy)-3-(2-fluorophenyl)propyl]-4-(2-methoxyphenyl)piperazine
V008-0301 Screening compound: 1-[3-(2-chloro-4-fluorophenoxy)-3-(2-fluorophenyl)propyl]-4-(2-methoxyphenyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-0301
1-[3-(2-chloro-4-fluorophenoxy)-3-(2-fluorophenyl)propyl]-4-(2-methoxyphenyl)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

V008-0301

Molecular Formula

C26H27ClF2N2O2 (C26 H27 ClF2 N2 O2)

Compound Name

1-[3-(2-chloro-4-fluorophenoxy)-3-(2-fluorophenyl)propyl]-4-(2-methoxyphenyl)piperazine

IUPAC name

1-[3-(2-chloro-4-fluorophenoxy)-3-(2-fluorophenyl)propyl]-4-(2-methoxyphenyl)piperazine

SMILES

COc(cccc1)c1N1CCN(CCC(c(cccc2)c2F)Oc(ccc(F)c2)c2Cl)CC1

InChI

InChI=1S/C26H27ClF2N2O2/c1-32-26-9-5-4-8-23(26)31-16-14-30(15-17-31)13-12-24(20-6-2-3-7-22(20)29)33-25-11-10-19(28)18-21(25)27/h2-11,18,24H,12-17H2,1H3/t24-/m0/s1

InChI Key

MGGQFEAEAKUGBC-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD19928817

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

472.96

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.287

Distribution Coefficient, logD

6.248

Water Solubility, LogSw

-6.22

Polar Surface Area

21.026

Acid Dissociation Constant (pKa)

26.66

Base Dissociation Constant (pKb)

6.37

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.80

V008-0301 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 V008-0301 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-0301?
Check Price and Availability of V008-0301, 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 V008-0301 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-0301
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-0301
  • 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 V008-0301 available by request