V014-4890 Screening compound: 3-{[4-(4-chlorophenyl)piperazin-1-yl]methyl}-N-propylbenzamide

V014-4890 Screening compound: 3-{[4-(4-chlorophenyl)piperazin-1-yl]methyl}-N-propylbenzamide
V014-4890 Screening compound: 3-{[4-(4-chlorophenyl)piperazin-1-yl]methyl}-N-propylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V014-4890
3-{[4-(4-chlorophenyl)piperazin-1-yl]methyl}-N-propylbenzamide

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

V014-4890

Molecular Formula

C21H26ClN3O (C21 H26 ClN3 O)

Compound Name

3-{[4-(4-chlorophenyl)piperazin-1-yl]methyl}-N-propylbenzamide

IUPAC name

3-{[4-(4-chlorophenyl)piperazin-1-yl]methyl}-N-propylbenzamide

SMILES

CCCNC(c1cccc(CN(CC2)CCN2c(cc2)ccc2Cl)c1)=O

InChI

InChI=1S/C21H26ClN3O/c1-2-10-23-21(26)18-5-3-4-17(15-18)16-24-11-13-25(14-12-24)20-8-6-19(22)7-9-20/h3-9,15H,2,10-14,16H2,1H3,(H,23,26)

InChI Key

VZIVOEXNNMUWBN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19914362

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

371.91

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.716

Distribution Coefficient, logD

3.684

Water Solubility, LogSw

-4.24

Polar Surface Area

31.758

Acid Dissociation Constant (pKa)

13.52

Base Dissociation Constant (pKb)

6.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

V014-4890 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Glucocorticoid receptors Library (4806 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Endocrine
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with V014-4890 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V014-4890?
Check Price and Availability of V014-4890, 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 V014-4890 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V014-4890
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V014-4890
  • 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 V014-4890 available by request