V002-9135 Screening compound: 1-{2-[bis(4-fluorophenyl)methoxy]ethyl}-4-(4-methanesulfonylbenzenesulfonyl)piperazine

V002-9135 Screening compound: 1-{2-[bis(4-fluorophenyl)methoxy]ethyl}-4-(4-methanesulfonylbenzenesulfonyl)piperazine
V002-9135 Screening compound: 1-{2-[bis(4-fluorophenyl)methoxy]ethyl}-4-(4-methanesulfonylbenzenesulfonyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound V002-9135
1-{2-[bis(4-fluorophenyl)methoxy]ethyl}-4-(4-methanesulfonylbenzenesulfonyl)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

V002-9135

Molecular Formula

C26H28F2N2O5S2 (C26 H28 F2 N2 O5 S2)

Compound Name

1-{2-[bis(4-fluorophenyl)methoxy]ethyl}-4-(4-methanesulfonylbenzenesulfonyl)piperazine

IUPAC name

1-{2-[bis(4-fluorophenyl)methoxy]ethyl}-4-(4-methanesulfonylbenzenesulfonyl)piperazine

SMILES

CS(c(cc1)ccc1S(N1CCN(CCOC(c(cc2)ccc2F)c(cc2)ccc2F)CC1)(=O)=O)(=O)=O

InChI

InChI=1S/C26H28F2N2O5S2/c1-36(31,32)24-10-12-25(13-11-24)37(33,34)30-16-14-29(15-17-30)18-19-35-26(20-2-6-22(27)7-3-20)21-4-8-23(28)9-5-21/h2-13,26H,14-19H2,1H3

InChI Key

PQLMRHUQFWEDQP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19965199

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

550.65

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.308

Distribution Coefficient, logD

3.300

Water Solubility, LogSw

-3.56

Polar Surface Area

72.119

Acid Dissociation Constant (pKa)

22.76

Base Dissociation Constant (pKb)

5.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.80

References: we are preparing a list of scientific research reports with V002-9135 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V002-9135?
Check Price and Availability of V002-9135, 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 V002-9135 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V002-9135
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V002-9135
  • 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 V002-9135 available by request