V016-9142 Screening compound: 2-(4-benzylpiperazin-1-yl)-1-[3-(2-methoxyphenyl)-5-phenyl-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one

V016-9142 Screening compound: 2-(4-benzylpiperazin-1-yl)-1-[3-(2-methoxyphenyl)-5-phenyl-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
V016-9142 Screening compound: 2-(4-benzylpiperazin-1-yl)-1-[3-(2-methoxyphenyl)-5-phenyl-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-9142
2-(4-benzylpiperazin-1-yl)-1-[3-(2-methoxyphenyl)-5-phenyl-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

V016-9142

Molecular Formula

C29H32N4O2 (C29 H32 N4 O2)

Compound Name

2-(4-benzylpiperazin-1-yl)-1-[3-(2-methoxyphenyl)-5-phenyl-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one

IUPAC name

2-(4-benzylpiperazin-1-yl)-1-[3-(2-methoxyphenyl)-5-phenyl-45-dihydro-1H-pyrazol-1-yl]ethan-1-one

SMILES

COc(cccc1)c1C(CC1c2ccccc2)=NN1C(CN1CCN(Cc2ccccc2)CC1)=O

InChI

InChI=1S/C29H32N4O2/c1-35-28-15-9-8-14-25(28)26-20-27(24-12-6-3-7-13-24)33(30-26)29(34)22-32-18-16-31(17-19-32)21-23-10-4-2-5-11-23/h2-15,27H,16-22H2,1H3/t27-/m0/s1

InChI Key

VWGKVMZFINSQAS-MHZLTWQESA-N

MDL Number (MFCD)

MFCD19886635

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

468.6

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.076

Distribution Coefficient, logD

3.937

Water Solubility, LogSw

-4.30

Polar Surface Area

41.762

Acid Dissociation Constant (pKa)

19.12

Base Dissociation Constant (pKb)

6.98

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.00

References: we are preparing a list of scientific research reports with V016-9142 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-9142?
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What is the minimum amount of V016-9142 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-9142
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-9142
  • 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 V016-9142 available by request