4092-0974 Screening compound: 2,6-dimethoxy-4-({4-[(pyridin-4-yl)methyl]piperazin-1-yl}methyl)phenol

4092-0974 Screening compound: 2,6-dimethoxy-4-({4-[(pyridin-4-yl)methyl]piperazin-1-yl}methyl)phenol
4092-0974 Screening compound: 2,6-dimethoxy-4-({4-[(pyridin-4-yl)methyl]piperazin-1-yl}methyl)phenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 4092-0974
2,6-dimethoxy-4-({4-[(pyridin-4-yl)methyl]piperazin-1-yl}methyl)phenol

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

4092-0974

Molecular Formula

C19H25N3O3 (C19 H25 N3 O3)

Compound Name

2,6-dimethoxy-4-({4-[(pyridin-4-yl)methyl]piperazin-1-yl}methyl)phenol

IUPAC name

26-dimethoxy-4-({4-[(pyridin-4-yl)methyl]piperazin-1-yl}methyl)phenol

SMILES

COc1cc(CN2CCN(Cc3ccncc3)CC2)cc(OC)c1O

InChI

InChI=1S/C19H25N3O3/c1-24-17-11-16(12-18(25-2)19(17)23)14-22-9-7-21(8-10-22)13-15-3-5-20-6-4-15/h3-6,11-12,23H,7-10,13-14H2,1-2H3

InChI Key

DBQCOPKIJVTJEK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02213190

Chemical and Physical Properties

Saltdata

HOOCCOOH

Molecular Weight

343.43

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.552

Distribution Coefficient, logD

-1.819

Water Solubility, LogSw

-1.00

Polar Surface Area

47.680

Acid Dissociation Constant (pKa)

9.41

Base Dissociation Constant (pKb)

10.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.10

4092-0974 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with 4092-0974 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4092-0974?
Check Price and Availability of 4092-0974, 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 4092-0974 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4092-0974
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4092-0974
  • 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 4092-0974 available by request