5695-0616 Screening compound: 4-(4-benzylpiperazin-1-yl)-2-(4-chlorophenyl)quinazoline

5695-0616 Screening compound: 4-(4-benzylpiperazin-1-yl)-2-(4-chlorophenyl)quinazoline
5695-0616 Screening compound: 4-(4-benzylpiperazin-1-yl)-2-(4-chlorophenyl)quinazoline alternative view

Chemical Structure Depiction of ChemDiv screening compound 5695-0616
4-(4-benzylpiperazin-1-yl)-2-(4-chlorophenyl)quinazoline

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

5695-0616

Molecular Formula

C25H23ClN4 (C25 H23 ClN4)

Compound Name

4-(4-benzylpiperazin-1-yl)-2-(4-chlorophenyl)quinazoline

IUPAC name

4-(4-benzylpiperazin-1-yl)-2-(4-chlorophenyl)quinazoline

SMILES

Clc(cc1)ccc1-c1nc2ccccc2c(N2CCN(Cc3ccccc3)CC2)n1

InChI

InChI=1S/C25H23ClN4/c26-21-12-10-20(11-13-21)24-27-23-9-5-4-8-22(23)25(28-24)30-16-14-29(15-17-30)18-19-6-2-1-3-7-19/h1-13H,14-18H2

InChI Key

NOPDPPMQYVNCOW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02031355

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.94

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.543

Distribution Coefficient, logD

5.959

Water Solubility, LogSw

-6.81

Polar Surface Area

25.179

Acid Dissociation Constant (pKa)

22.11

Base Dissociation Constant (pKb)

7.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

5695-0616 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 5695-0616 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5695-0616?
Check Price and Availability of 5695-0616, 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 5695-0616 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5695-0616
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5695-0616
  • 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 5695-0616 available by request