V009-4657 Screening compound: 4-[4-(2-fluorobenzamido)phenyl]-3-(3-methoxyphenyl)-1-phenyl-1H-pyrazol-5-yl acetate

V009-4657 Screening compound: 4-[4-(2-fluorobenzamido)phenyl]-3-(3-methoxyphenyl)-1-phenyl-1H-pyrazol-5-yl acetate
V009-4657 Screening compound: 4-[4-(2-fluorobenzamido)phenyl]-3-(3-methoxyphenyl)-1-phenyl-1H-pyrazol-5-yl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound V009-4657
4-[4-(2-fluorobenzamido)phenyl]-3-(3-methoxyphenyl)-1-phenyl-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

V009-4657

Molecular Formula

C31H24FN3O4 (C31 H24 FN3 O4)

Compound Name

4-[4-(2-fluorobenzamido)phenyl]-3-(3-methoxyphenyl)-1-phenyl-1H-pyrazol-5-yl acetate

IUPAC name

4-[4-(2-fluorobenzamido)phenyl]-3-(3-methoxyphenyl)-1-phenyl-1H-pyrazol-5-yl acetate

SMILES

CC(Oc(n(-c1ccccc1)nc1-c2cc(OC)ccc2)c1-c(cc1)ccc1NC(c(cccc1)c1F)=O)=O

InChI

InChI=1S/C31H24FN3O4/c1-20(36)39-31-28(21-15-17-23(18-16-21)33-30(37)26-13-6-7-14-27(26)32)29(22-9-8-12-25(19-22)38-2)34-35(31)24-10-4-3-5-11-24/h3-19H,1-2H3,(H,33,37)

InChI Key

XRPKAMYNHLEXCC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19868366

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

521.55

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.101

Distribution Coefficient, logD

6.100

Water Solubility, LogSw

-5.54

Polar Surface Area

65.209

Acid Dissociation Constant (pKa)

10.46

Base Dissociation Constant (pKb)

-0.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.50

References: we are preparing a list of scientific research reports with V009-4657 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V009-4657?
Check Price and Availability of V009-4657, 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 V009-4657 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V009-4657
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V009-4657
  • 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 V009-4657 available by request