6809-0014 Screening compound: 6-[(4-benzylpiperidin-1-yl)methyl]-N2-(4-methoxyphenyl)-1,3,5-triazine-2,4-diamine

6809-0014 Screening compound: 6-[(4-benzylpiperidin-1-yl)methyl]-N2-(4-methoxyphenyl)-1,3,5-triazine-2,4-diamine
6809-0014 Screening compound: 6-[(4-benzylpiperidin-1-yl)methyl]-N2-(4-methoxyphenyl)-1,3,5-triazine-2,4-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound 6809-0014
6-[(4-benzylpiperidin-1-yl)methyl]-N2-(4-methoxyphenyl)-1,3,5-triazine-2,4-diamine

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

6809-0014

Molecular Formula

C23H28N6O (C23 H28 N6 O)

Compound Name

6-[(4-benzylpiperidin-1-yl)methyl]-N2-(4-methoxyphenyl)-1,3,5-triazine-2,4-diamine

IUPAC name

6-[(4-benzylpiperidin-1-yl)methyl]-N2-(4-methoxyphenyl)-135-triazine-24-diamine

SMILES

COc(cc1)ccc1Nc1nc(N)nc(CN2CCC(Cc3ccccc3)CC2)n1

InChI

InChI=1S/C23H28N6O/c1-30-20-9-7-19(8-10-20)25-23-27-21(26-22(24)28-23)16-29-13-11-18(12-14-29)15-17-5-3-2-4-6-17/h2-10,18H,11-16H2,1H3,(H3,24,25,26,27,28)

InChI Key

WDYIDAUIWRIEAK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04159367

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

404.52

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.591

Distribution Coefficient, logD

4.090

Water Solubility, LogSw

-4.49

Polar Surface Area

72.613

Acid Dissociation Constant (pKa)

17.23

Base Dissociation Constant (pKb)

7.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

6809-0014 in Drug Discovery

Included in Screening Libraries

CNS targets activity set (6557 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with 6809-0014 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6809-0014?
Check Price and Availability of 6809-0014, 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 6809-0014 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6809-0014
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6809-0014
  • 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 6809-0014 available by request