V014-6565 Screening compound: methyl 4-{[1-(4-chlorophenyl)-2-(4-cyclohexanecarbonylpiperazin-1-yl)ethoxy]methyl}benzoate

V014-6565 Screening compound: methyl 4-{[1-(4-chlorophenyl)-2-(4-cyclohexanecarbonylpiperazin-1-yl)ethoxy]methyl}benzoate
V014-6565 Screening compound: methyl 4-{[1-(4-chlorophenyl)-2-(4-cyclohexanecarbonylpiperazin-1-yl)ethoxy]methyl}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound V014-6565
methyl 4-{[1-(4-chlorophenyl)-2-(4-cyclohexanecarbonylpiperazin-1-yl)ethoxy]methyl}benzoate

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

V014-6565

Molecular Formula

C28H35ClN2O4 (C28 H35 ClN2 O4)

Compound Name

methyl 4-{[1-(4-chlorophenyl)-2-(4-cyclohexanecarbonylpiperazin-1-yl)ethoxy]methyl}benzoate

IUPAC name

methyl 4-{[1-(4-chlorophenyl)-2-(4-cyclohexanecarbonylpiperazin-1-yl)ethoxy]methyl}benzoate

SMILES

COC(c1ccc(COC(CN(CC2)CCN2C(C2CCCCC2)=O)c(cc2)ccc2Cl)cc1)=O

InChI

InChI=1S/C28H35ClN2O4/c1-34-28(33)24-9-7-21(8-10-24)20-35-26(22-11-13-25(29)14-12-22)19-30-15-17-31(18-16-30)27(32)23-5-3-2-4-6-23/h7-14,23,26H,2-6,15-20H2,1H3/t26-/m0/s1

InChI Key

APKBJGMTVWOXOE-SANMLTNESA-N

MDL Number (MFCD)

MFCD19952591

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

499.05

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.153

Distribution Coefficient, logD

5.144

Water Solubility, LogSw

-5.84

Polar Surface Area

48.674

Acid Dissociation Constant (pKa)

23.09

Base Dissociation Constant (pKb)

5.75

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

V014-6565 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with V014-6565 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V014-6565?
Check Price and Availability of V014-6565, 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 V014-6565 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V014-6565
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V014-6565
  • 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 V014-6565 available by request