V003-4990 Screening compound: 1-[(4-chlorophenyl)sulfonyl]-4-[(4-fluorophenyl)(phenyl)methyl]piperazine

V003-4990 Screening compound: 1-[(4-chlorophenyl)sulfonyl]-4-[(4-fluorophenyl)(phenyl)methyl]piperazine
V003-4990 Screening compound: 1-[(4-chlorophenyl)sulfonyl]-4-[(4-fluorophenyl)(phenyl)methyl]piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-4990
1-[(4-chlorophenyl)sulfonyl]-4-[(4-fluorophenyl)(phenyl)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

V003-4990

Molecular Formula

C23H22ClFN2O2S (C23 H22 ClFN2 O2 S)

Compound Name

1-[(4-chlorophenyl)sulfonyl]-4-[(4-fluorophenyl)(phenyl)methyl]piperazine

IUPAC name

1-(4-chlorobenzenesulfonyl)-4-[(4-fluorophenyl)(phenyl)methyl]piperazine

SMILES

O=S(c(cc1)ccc1Cl)(N(CC1)CCN1C(c1ccccc1)c(cc1)ccc1F)=O

InChI

InChI=1S/C23H22ClFN2O2S/c24-20-8-12-22(13-9-20)30(28,29)27-16-14-26(15-17-27)23(18-4-2-1-3-5-18)19-6-10-21(25)11-7-19/h1-13,23H,14-17H2/t23-/m0/s1

InChI Key

YILMYCJYOFQSDY-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD19963399

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

444.96

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.253

Distribution Coefficient, logD

5.253

Water Solubility, LogSw

-6.16

Polar Surface Area

34.511

Acid Dissociation Constant (pKa)

24.59

Base Dissociation Constant (pKb)

4.22

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

21.70

V003-4990 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with V003-4990 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-4990?
Check Price and Availability of V003-4990, 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 V003-4990 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-4990
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-4990
  • 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 V003-4990 available by request