V014-5999 Screening compound: 2-[4-(4-chlorobenzoyl)piperazin-1-yl]-2-cyclopentyl-N-(3-methoxyphenyl)acetamide

V014-5999 Screening compound: 2-[4-(4-chlorobenzoyl)piperazin-1-yl]-2-cyclopentyl-N-(3-methoxyphenyl)acetamide
V014-5999 Screening compound: 2-[4-(4-chlorobenzoyl)piperazin-1-yl]-2-cyclopentyl-N-(3-methoxyphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V014-5999
2-[4-(4-chlorobenzoyl)piperazin-1-yl]-2-cyclopentyl-N-(3-methoxyphenyl)acetamide

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

V014-5999

Molecular Formula

C25H30ClN3O3 (C25 H30 ClN3 O3)

Compound Name

2-[4-(4-chlorobenzoyl)piperazin-1-yl]-2-cyclopentyl-N-(3-methoxyphenyl)acetamide

IUPAC name

2-[4-(4-chlorobenzoyl)piperazin-1-yl]-2-cyclopentyl-N-(3-methoxyphenyl)acetamide

SMILES

COc1cccc(NC(C(C2CCCC2)N(CC2)CCN2C(c(cc2)ccc2Cl)=O)=O)c1

InChI

InChI=1S/C25H30ClN3O3/c1-32-22-8-4-7-21(17-22)27-24(30)23(18-5-2-3-6-18)28-13-15-29(16-14-28)25(31)19-9-11-20(26)12-10-19/h4,7-12,17-18,23H,2-3,5-6,13-16H2,1H3,(H,27,30)/t23-/m0/s1

InChI Key

SIYNRXVAPGPTQC-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD19883024

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

455.98

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.982

Distribution Coefficient, logD

3.982

Water Solubility, LogSw

-4.44

Polar Surface Area

50.913

Acid Dissociation Constant (pKa)

10.96

Base Dissociation Constant (pKb)

2.78

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

44.00

V014-5999 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 V014-5999 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V014-5999?
Check Price and Availability of V014-5999, 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 V014-5999 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V014-5999
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V014-5999
  • 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 V014-5999 available by request