V031-0772 Screening compound: N-[1-(2-chlorophenyl)-3-phenyl-1H-pyrazol-5-yl]-4-(trifluoromethoxy)benzamide

V031-0772 Screening compound: N-[1-(2-chlorophenyl)-3-phenyl-1H-pyrazol-5-yl]-4-(trifluoromethoxy)benzamide
V031-0772 Screening compound: N-[1-(2-chlorophenyl)-3-phenyl-1H-pyrazol-5-yl]-4-(trifluoromethoxy)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V031-0772
N-[1-(2-chlorophenyl)-3-phenyl-1H-pyrazol-5-yl]-4-(trifluoromethoxy)benzamide

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

V031-0772

Molecular Formula

C23H15ClF3N3O2 (C23 H15 ClF3 N3 O2)

Compound Name

N-[1-(2-chlorophenyl)-3-phenyl-1H-pyrazol-5-yl]-4-(trifluoromethoxy)benzamide

IUPAC name

N-[1-(2-chlorophenyl)-3-phenyl-1H-pyrazol-5-yl]-4-(trifluoromethoxy)benzamide

SMILES

O=C(c(cc1)ccc1OC(F)(F)F)Nc1cc(-c2ccccc2)nn1-c(cccc1)c1Cl

InChI

InChI=1S/C23H15ClF3N3O2/c24-18-8-4-5-9-20(18)30-21(14-19(29-30)15-6-2-1-3-7-15)28-22(31)16-10-12-17(13-11-16)32-23(25,26)27/h1-14H,(H,28,31)

InChI Key

ZDSVVWYVXONWOB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19950158

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

457.84

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.846

Distribution Coefficient, logD

6.846

Water Solubility, LogSw

-6.59

Polar Surface Area

43.129

Acid Dissociation Constant (pKa)

11.40

Base Dissociation Constant (pKb)

-4.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.30

V031-0772 in Drug Discovery

Included in Screening Libraries

Type II Kinase Inhibitors Library (6956 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Hemic and lymphatic
  • Endocrine
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with V031-0772 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V031-0772?
Check Price and Availability of V031-0772, 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 V031-0772 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V031-0772
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V031-0772
  • 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 V031-0772 available by request