V007-8369 Screening compound: 4-phenyl-1-(4-{3-[3-(trifluoromethyl)phenyl]-1H-pyrazol-5-yl}benzoyl)-1,2,3,6-tetrahydropyridine

V007-8369 Screening compound: 4-phenyl-1-(4-{3-[3-(trifluoromethyl)phenyl]-1H-pyrazol-5-yl}benzoyl)-1,2,3,6-tetrahydropyridine
V007-8369 Screening compound: 4-phenyl-1-(4-{3-[3-(trifluoromethyl)phenyl]-1H-pyrazol-5-yl}benzoyl)-1,2,3,6-tetrahydropyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound V007-8369
4-phenyl-1-(4-{3-[3-(trifluoromethyl)phenyl]-1H-pyrazol-5-yl}benzoyl)-1,2,3,6-tetrahydropyridine

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

V007-8369

Molecular Formula

C28H22F3N3O (C28 H22 F3 N3 O)

Compound Name

4-phenyl-1-(4-{3-[3-(trifluoromethyl)phenyl]-1H-pyrazol-5-yl}benzoyl)-1,2,3,6-tetrahydropyridine

IUPAC name

4-phenyl-1-(4-{3-[3-(trifluoromethyl)phenyl]-1H-pyrazol-5-yl}benzoyl)-1236-tetrahydropyridine

SMILES

O=C(c(cc1)ccc1-c1cc(-c2cccc(C(F)(F)F)c2)n[nH]1)N(CC1)CC=C1c1ccccc1

InChI

InChI=1S/C28H22F3N3O/c29-28(30,31)24-8-4-7-23(17-24)26-18-25(32-33-26)21-9-11-22(12-10-21)27(35)34-15-13-20(14-16-34)19-5-2-1-3-6-19/h1-13,17-18H,14-16H2,(H,32,33)

InChI Key

NGXMFDNMEALVGP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19953902

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

473.5

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.556

Distribution Coefficient, logD

6.556

Water Solubility, LogSw

-6.45

Polar Surface Area

38.833

Acid Dissociation Constant (pKa)

8.35

Base Dissociation Constant (pKb)

-0.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

V007-8369 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

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

DGK Inhibitors Library (10558 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with V007-8369 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V007-8369?
Check Price and Availability of V007-8369, 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 V007-8369 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V007-8369
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V007-8369
  • 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 V007-8369 available by request