V018-0167 Screening compound: 1-(4-fluorophenyl)-3-(propan-2-yl)-1H-pyrazol-5-yl 3,5-dichlorobenzoate

V018-0167 Screening compound: 1-(4-fluorophenyl)-3-(propan-2-yl)-1H-pyrazol-5-yl 3,5-dichlorobenzoate
V018-0167 Screening compound: 1-(4-fluorophenyl)-3-(propan-2-yl)-1H-pyrazol-5-yl 3,5-dichlorobenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-0167
1-(4-fluorophenyl)-3-(propan-2-yl)-1H-pyrazol-5-yl 3,5-dichlorobenzoate

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

V018-0167

Molecular Formula

C19H15Cl2FN2O2 (C19 H15 Cl2 FN2 O2)

Compound Name

1-(4-fluorophenyl)-3-(propan-2-yl)-1H-pyrazol-5-yl 3,5-dichlorobenzoate

IUPAC name

1-(4-fluorophenyl)-3-(propan-2-yl)-1H-pyrazol-5-yl 35-dichlorobenzoate

SMILES

CC(C)c(cc1OC(c2cc(Cl)cc(Cl)c2)=O)nn1-c(cc1)ccc1F

InChI

InChI=1S/C19H15Cl2FN2O2/c1-11(2)17-10-18(24(23-17)16-5-3-15(22)4-6-16)26-19(25)12-7-13(20)9-14(21)8-12/h3-11H,1-2H3

InChI Key

YJOQLJDMKZQUSK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19976983

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.24

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.745

Distribution Coefficient, logD

5.745

Water Solubility, LogSw

-6.07

Polar Surface Area

34.111

Acid Dissociation Constant (pKa)

27.26

Base Dissociation Constant (pKb)

-2.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

V018-0167 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with V018-0167 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-0167?
Check Price and Availability of V018-0167, 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 V018-0167 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-0167
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-0167
  • 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 V018-0167 available by request