V028-2061 Screening compound: 5-benzyl-4-[4-(4-tert-butylbenzenesulfonyl)piperazin-1-yl]-6-methyl-2-[3-(trifluoromethyl)phenyl]pyrimidine

V028-2061 Screening compound: 5-benzyl-4-[4-(4-tert-butylbenzenesulfonyl)piperazin-1-yl]-6-methyl-2-[3-(trifluoromethyl)phenyl]pyrimidine
V028-2061 Screening compound: 5-benzyl-4-[4-(4-tert-butylbenzenesulfonyl)piperazin-1-yl]-6-methyl-2-[3-(trifluoromethyl)phenyl]pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-2061
5-benzyl-4-[4-(4-tert-butylbenzenesulfonyl)piperazin-1-yl]-6-methyl-2-[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

V028-2061

Molecular Formula

C33H35F3N4O2S (C33 H35 F3 N4 O2 S)

Compound Name

5-benzyl-4-[4-(4-tert-butylbenzenesulfonyl)piperazin-1-yl]-6-methyl-2-[3-(trifluoromethyl)phenyl]pyrimidine

IUPAC name

5-benzyl-4-[4-(4-tert-butylbenzenesulfonyl)piperazin-1-yl]-6-methyl-2-[3-(trifluoromethyl)phenyl]pyrimidine

SMILES

CC(C)(C)c(cc1)ccc1S(N(CC1)CCN1c1nc(-c2cc(C(F)(F)F)ccc2)nc(C)c1Cc1ccccc1)(=O)=O

InChI

InChI=1S/C33H35F3N4O2S/c1-23-29(21-24-9-6-5-7-10-24)31(38-30(37-23)25-11-8-12-27(22-25)33(34,35)36)39-17-19-40(20-18-39)43(41,42)28-15-13-26(14-16-28)32(2,3)4/h5-16,22H,17-21H2,1-4H3

InChI Key

FCSZBDLFPYIJRL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19851915

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

608.73

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

9.194

Distribution Coefficient, logD

9.188

Water Solubility, LogSw

-6.11

Polar Surface Area

53.748

Acid Dissociation Constant (pKa)

20.84

Base Dissociation Constant (pKb)

5.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with V028-2061 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-2061?
Check Price and Availability of V028-2061, 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 V028-2061 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-2061
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-2061
  • 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 V028-2061 available by request