V004-2408 Screening compound: 1-[BIS(4-FLUOROPHENYL)METHYL]-4-(1-TERT-BUTYL-3-METHYL-1H-PYRAZOLE-5-CARBONYL)PIPERAZINE

V004-2408 Screening compound: 1-[BIS(4-FLUOROPHENYL)METHYL]-4-(1-TERT-BUTYL-3-METHYL-1H-PYRAZOLE-5-CARBONYL)PIPERAZINE
V004-2408 Screening compound: 1-[BIS(4-FLUOROPHENYL)METHYL]-4-(1-TERT-BUTYL-3-METHYL-1H-PYRAZOLE-5-CARBONYL)PIPERAZINE alternative view

Chemical Structure Depiction of ChemDiv screening compound V004-2408
1-[BIS(4-FLUOROPHENYL)METHYL]-4-(1-TERT-BUTYL-3-METHYL-1H-PYRAZOLE-5-CARBONYL)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

V004-2408

Molecular Formula

C26H30F2N4O (C26 H30 F2 N4 O)

Compound Name

1-[BIS(4-FLUOROPHENYL)METHYL]-4-(1-TERT-BUTYL-3-METHYL-1H-PYRAZOLE-5-CARBONYL)PIPERAZINE

IUPAC name

1-[bis(4-fluorophenyl)methyl]-4-(1-tert-butyl-3-methyl-1H-pyrazole-5-carbonyl)piperazine

SMILES

CC(C)(C)n1nc(C)cc1C(N(CC1)CCN1C(c(cc1)ccc1F)c(cc1)ccc1F)=O

InChI

InChI=1S/C26H30F2N4O/c1-18-17-23(32(29-18)26(2,3)4)25(33)31-15-13-30(14-16-31)24(19-5-9-21(27)10-6-19)20-7-11-22(28)12-8-20/h5-12,17,24H,13-16H2,1-4H3

InChI Key

YUIPUCXIUFHOIJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14286156

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

452.55

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

4.120

Distribution Coefficient, logD

4.119

Water Solubility, LogSw

-4.09

Polar Surface Area

33.316

Acid Dissociation Constant (pKa)

24.12

Base Dissociation Constant (pKb)

4.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.50

V004-2408 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

DGK Inhibitors Library (10558 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with V004-2408 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V004-2408?
Check Price and Availability of V004-2408, 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 V004-2408 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V004-2408
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V004-2408
  • 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 V004-2408 available by request