V008-1834 Screening compound: 1-{4-[2-(4-chlorophenyl)-2-[(3-methylphenyl)methoxy]ethyl]piperazin-1-yl}pentan-1-one

V008-1834 Screening compound: 1-{4-[2-(4-chlorophenyl)-2-[(3-methylphenyl)methoxy]ethyl]piperazin-1-yl}pentan-1-one
V008-1834 Screening compound: 1-{4-[2-(4-chlorophenyl)-2-[(3-methylphenyl)methoxy]ethyl]piperazin-1-yl}pentan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-1834
1-{4-[2-(4-chlorophenyl)-2-[(3-methylphenyl)methoxy]ethyl]piperazin-1-yl}pentan-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

V008-1834

Molecular Formula

C25H33ClN2O2 (C25 H33 ClN2 O2)

Compound Name

1-{4-[2-(4-chlorophenyl)-2-[(3-methylphenyl)methoxy]ethyl]piperazin-1-yl}pentan-1-one

IUPAC name

1-{4-[2-(4-chlorophenyl)-2-[(3-methylphenyl)methoxy]ethyl]piperazin-1-yl}pentan-1-one

SMILES

CCCCC(N1CCN(CC(c(cc2)ccc2Cl)OCc2cc(C)ccc2)CC1)=O

InChI

InChI=1S/C25H33ClN2O2/c1-3-4-8-25(29)28-15-13-27(14-16-28)18-24(22-9-11-23(26)12-10-22)30-19-21-7-5-6-20(2)17-21/h5-7,9-12,17,24H,3-4,8,13-16,18-19H2,1-2H3/t24-/m0/s1

InChI Key

VJJIBTQESVLYPK-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD19952543

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

429

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.148

Distribution Coefficient, logD

5.142

Water Solubility, LogSw

-5.67

Polar Surface Area

27.052

Acid Dissociation Constant (pKa)

23.09

Base Dissociation Constant (pKb)

5.54

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

48.00

V008-1834 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system

References: we are preparing a list of scientific research reports with V008-1834 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-1834?
Check Price and Availability of V008-1834, 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 V008-1834 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-1834
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-1834
  • 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 V008-1834 available by request