V022-8588 Screening compound: 2-(4-benzylpiperidin-1-yl)-1-[5-(2,4-dimethoxyphenyl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one

V022-8588 Screening compound: 2-(4-benzylpiperidin-1-yl)-1-[5-(2,4-dimethoxyphenyl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
V022-8588 Screening compound: 2-(4-benzylpiperidin-1-yl)-1-[5-(2,4-dimethoxyphenyl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-8588
2-(4-benzylpiperidin-1-yl)-1-[5-(2,4-dimethoxyphenyl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one

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

V022-8588

Molecular Formula

C31H34FN3O3 (C31 H34 FN3 O3)

Compound Name

2-(4-benzylpiperidin-1-yl)-1-[5-(2,4-dimethoxyphenyl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one

IUPAC name

2-(4-benzylpiperidin-1-yl)-1-[5-(24-dimethoxyphenyl)-3-(4-fluorophenyl)-45-dihydro-1H-pyrazol-1-yl]ethan-1-one

SMILES

COc1cc(OC)c(C(C2)N(C(CN3CCC(Cc4ccccc4)CC3)=O)N=C2c(cc2)ccc2F)cc1

InChI

InChI=1S/C31H34FN3O3/c1-37-26-12-13-27(30(19-26)38-2)29-20-28(24-8-10-25(32)11-9-24)33-35(29)31(36)21-34-16-14-23(15-17-34)18-22-6-4-3-5-7-22/h3-13,19,23,29H,14-18,20-21H2,1-2H3/t29-/m1/s1

InChI Key

NSZWIQUYJDSWBA-GDLZYMKVSA-N

MDL Number (MFCD)

MFCD19886587

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

515.63

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.193

Distribution Coefficient, logD

6.117

Water Solubility, LogSw

-5.65

Polar Surface Area

45.494

Acid Dissociation Constant (pKa)

19.12

Base Dissociation Constant (pKb)

6.68

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.50

References: we are preparing a list of scientific research reports with V022-8588 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V022-8588?
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What is the minimum amount of V022-8588 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-8588
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-8588
  • 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 V022-8588 available by request