V008-2377 Screening compound: 2-(4-benzylpiperidin-1-yl)-1-[3-(2-chlorophenyl)-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one

V008-2377 Screening compound: 2-(4-benzylpiperidin-1-yl)-1-[3-(2-chlorophenyl)-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
V008-2377 Screening compound: 2-(4-benzylpiperidin-1-yl)-1-[3-(2-chlorophenyl)-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-2377
2-(4-benzylpiperidin-1-yl)-1-[3-(2-chlorophenyl)-5-(4-methoxyphenyl)-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

V008-2377

Molecular Formula

C30H32ClN3O2 (C30 H32 ClN3 O2)

Compound Name

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

IUPAC name

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

SMILES

COc1ccc(C(C2)N(C(CN3CCC(Cc4ccccc4)CC3)=O)N=C2c(cccc2)c2Cl)cc1

InChI

InChI=1S/C30H32ClN3O2/c1-36-25-13-11-24(12-14-25)29-20-28(26-9-5-6-10-27(26)31)32-34(29)30(35)21-33-17-15-23(16-18-33)19-22-7-3-2-4-8-22/h2-14,23,29H,15-21H2,1H3/t29-/m1/s1

InChI Key

ZGCHHNAJJLYJJU-GDLZYMKVSA-N

MDL Number (MFCD)

MFCD19885478

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

502.06

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.427

Distribution Coefficient, logD

6.351

Water Solubility, LogSw

-6.09

Polar Surface Area

37.864

Acid Dissociation Constant (pKa)

18.73

Base Dissociation Constant (pKb)

6.68

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

V008-2377 in Drug Discovery

Included in Screening Libraries

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

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 V008-2377 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-2377?
Check Price and Availability of V008-2377, 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 V008-2377 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-2377
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-2377
  • 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 V008-2377 available by request