V017-3888 Screening compound: 1-[3-(2-chlorophenyl)-5-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(4-ethylpiperazin-1-yl)ethan-1-one

V017-3888 Screening compound: 1-[3-(2-chlorophenyl)-5-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(4-ethylpiperazin-1-yl)ethan-1-one
V017-3888 Screening compound: 1-[3-(2-chlorophenyl)-5-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(4-ethylpiperazin-1-yl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V017-3888
1-[3-(2-chlorophenyl)-5-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(4-ethylpiperazin-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

V017-3888

Molecular Formula

C24H29ClN4O (C24 H29 ClN4 O)

Compound Name

1-[3-(2-chlorophenyl)-5-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(4-ethylpiperazin-1-yl)ethan-1-one

IUPAC name

1-[3-(2-chlorophenyl)-5-(4-methylphenyl)-45-dihydro-1H-pyrazol-1-yl]-2-(4-ethylpiperazin-1-yl)ethan-1-one

SMILES

CCN1CCN(CC(N(C(C2)c3ccc(C)cc3)N=C2c(cccc2)c2Cl)=O)CC1

InChI

InChI=1S/C24H29ClN4O/c1-3-27-12-14-28(15-13-27)17-24(30)29-23(19-10-8-18(2)9-11-19)16-22(26-29)20-6-4-5-7-21(20)25/h4-11,23H,3,12-17H2,1-2H3/t23-/m1/s1

InChI Key

OOVIEOKKDDWYOQ-HSZRJFAPSA-N

MDL Number (MFCD)

MFCD19885335

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

424.97

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.988

Distribution Coefficient, logD

3.194

Water Solubility, LogSw

-4.42

Polar Surface Area

34.128

Acid Dissociation Constant (pKa)

18.73

Base Dissociation Constant (pKb)

8.12

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

41.70

V017-3888 in Drug Discovery

Included in Screening Libraries

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with V017-3888 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V017-3888?
Check Price and Availability of V017-3888, 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 V017-3888 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V017-3888
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V017-3888
  • 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 V017-3888 available by request