V011-0291 Screening compound: 4-[4-(3-bromobenzamido)phenyl]-1-(2,5-dimethylphenyl)-3-(4-fluorophenyl)-1H-pyrazol-5-yl acetate

V011-0291 Screening compound: 4-[4-(3-bromobenzamido)phenyl]-1-(2,5-dimethylphenyl)-3-(4-fluorophenyl)-1H-pyrazol-5-yl acetate
V011-0291 Screening compound: 4-[4-(3-bromobenzamido)phenyl]-1-(2,5-dimethylphenyl)-3-(4-fluorophenyl)-1H-pyrazol-5-yl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound V011-0291
4-[4-(3-bromobenzamido)phenyl]-1-(2,5-dimethylphenyl)-3-(4-fluorophenyl)-1H-pyrazol-5-yl acetate

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

V011-0291

Molecular Formula

C32H25BrFN3O3 (C32 H25 BrFN3 O3)

Compound Name

4-[4-(3-bromobenzamido)phenyl]-1-(2,5-dimethylphenyl)-3-(4-fluorophenyl)-1H-pyrazol-5-yl acetate

IUPAC name

4-[4-(3-bromobenzamido)phenyl]-1-(25-dimethylphenyl)-3-(4-fluorophenyl)-1H-pyrazol-5-yl acetate

SMILES

CC(Oc(n(-c1c(C)ccc(C)c1)nc1-c(cc2)ccc2F)c1-c(cc1)ccc1NC(c1cccc(Br)c1)=O)=O

InChI

InChI=1S/C32H25BrFN3O3/c1-19-7-8-20(2)28(17-19)37-32(40-21(3)38)29(30(36-37)23-9-13-26(34)14-10-23)22-11-15-27(16-12-22)35-31(39)24-5-4-6-25(33)18-24/h4-18H,1-3H3,(H,35,39)

InChI Key

TVKVOUKCMFORPH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19868659

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

598.47

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

7.927

Distribution Coefficient, logD

7.927

Water Solubility, LogSw

-5.77

Polar Surface Area

57.364

Acid Dissociation Constant (pKa)

10.51

Base Dissociation Constant (pKb)

-2.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.40

V011-0291 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

MCL1 Targeted Library (12200 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic

References: we are preparing a list of scientific research reports with V011-0291 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V011-0291?
Check Price and Availability of V011-0291, 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 V011-0291 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V011-0291
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V011-0291
  • 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 V011-0291 available by request