V008-8441 Screening compound: 2,4-dimethyl-5-[(3-methylphenyl)methyl]-6-{4-[3-(trifluoromethyl)benzoyl]piperazin-1-yl}pyrimidine

V008-8441 Screening compound: 2,4-dimethyl-5-[(3-methylphenyl)methyl]-6-{4-[3-(trifluoromethyl)benzoyl]piperazin-1-yl}pyrimidine
V008-8441 Screening compound: 2,4-dimethyl-5-[(3-methylphenyl)methyl]-6-{4-[3-(trifluoromethyl)benzoyl]piperazin-1-yl}pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-8441
2,4-dimethyl-5-[(3-methylphenyl)methyl]-6-{4-[3-(trifluoromethyl)benzoyl]piperazin-1-yl}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

V008-8441

Molecular Formula

C26H27F3N4O (C26 H27 F3 N4 O)

Compound Name

2,4-dimethyl-5-[(3-methylphenyl)methyl]-6-{4-[3-(trifluoromethyl)benzoyl]piperazin-1-yl}pyrimidine

IUPAC name

24-dimethyl-5-[(3-methylphenyl)methyl]-6-{4-[3-(trifluoromethyl)benzoyl]piperazin-1-yl}pyrimidine

SMILES

Cc1cccc(Cc2c(C)nc(C)nc2N(CC2)CCN2C(c2cccc(C(F)(F)F)c2)=O)c1

InChI

InChI=1S/C26H27F3N4O/c1-17-6-4-7-20(14-17)15-23-18(2)30-19(3)31-24(23)32-10-12-33(13-11-32)25(34)21-8-5-9-22(16-21)26(27,28)29/h4-9,14,16H,10-13,15H2,1-3H3

InChI Key

GRCDXJHBUBKDTH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19850435

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

468.52

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.505

Distribution Coefficient, logD

5.416

Water Solubility, LogSw

-5.62

Polar Surface Area

38.569

Acid Dissociation Constant (pKa)

20.84

Base Dissociation Constant (pKb)

6.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.60

V008-8441 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system

References: we are preparing a list of scientific research reports with V008-8441 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-8441?
Check Price and Availability of V008-8441, 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 V008-8441 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-8441
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-8441
  • 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 V008-8441 available by request