V006-4965 Screening compound: 2-[4-(4-ethylbenzenesulfonyl)piperazin-1-yl]-4-[3-(trifluoromethyl)phenyl]pyrimidine

V006-4965 Screening compound: 2-[4-(4-ethylbenzenesulfonyl)piperazin-1-yl]-4-[3-(trifluoromethyl)phenyl]pyrimidine
V006-4965 Screening compound: 2-[4-(4-ethylbenzenesulfonyl)piperazin-1-yl]-4-[3-(trifluoromethyl)phenyl]pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound V006-4965
2-[4-(4-ethylbenzenesulfonyl)piperazin-1-yl]-4-[3-(trifluoromethyl)phenyl]pyrimidine

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

V006-4965

Molecular Formula

C23H23F3N4O2S (C23 H23 F3 N4 O2 S)

Compound Name

2-[4-(4-ethylbenzenesulfonyl)piperazin-1-yl]-4-[3-(trifluoromethyl)phenyl]pyrimidine

IUPAC name

2-[4-(4-ethylbenzenesulfonyl)piperazin-1-yl]-4-[3-(trifluoromethyl)phenyl]pyrimidine

SMILES

CCc(cc1)ccc1S(N(CC1)CCN1c1nc(-c2cc(C(F)(F)F)ccc2)ccn1)(=O)=O

InChI

InChI=1S/C23H23F3N4O2S/c1-2-17-6-8-20(9-7-17)33(31,32)30-14-12-29(13-15-30)22-27-11-10-21(28-22)18-4-3-5-19(16-18)23(24,25)26/h3-11,16H,2,12-15H2,1H3

InChI Key

IPMWQXRQZQIONM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19943702

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

476.52

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.687

Distribution Coefficient, logD

5.687

Water Solubility, LogSw

-5.68

Polar Surface Area

52.868

Acid Dissociation Constant (pKa)

20.87

Base Dissociation Constant (pKb)

3.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

References: we are preparing a list of scientific research reports with V006-4965 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V006-4965?
Check Price and Availability of V006-4965, 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 V006-4965 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V006-4965
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V006-4965
  • 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 V006-4965 available by request