4092-0849 Screening compound: 1-[(2,5-dimethoxyphenyl)methyl]-4-[(3-ethoxy-4-methoxyphenyl)methyl]piperazine

4092-0849 Screening compound: 1-[(2,5-dimethoxyphenyl)methyl]-4-[(3-ethoxy-4-methoxyphenyl)methyl]piperazine
4092-0849 Screening compound: 1-[(2,5-dimethoxyphenyl)methyl]-4-[(3-ethoxy-4-methoxyphenyl)methyl]piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound 4092-0849
1-[(2,5-dimethoxyphenyl)methyl]-4-[(3-ethoxy-4-methoxyphenyl)methyl]piperazine

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

4092-0849

Molecular Formula

C23H32N2O4 (C23 H32 N2 O4)

Compound Name

1-[(2,5-dimethoxyphenyl)methyl]-4-[(3-ethoxy-4-methoxyphenyl)methyl]piperazine

IUPAC name

1-[(25-dimethoxyphenyl)methyl]-4-[(3-ethoxy-4-methoxyphenyl)methyl]piperazine

SMILES

CCOc(cc(CN1CCN(Cc(cc(cc2)OC)c2OC)CC1)cc1)c1OC

InChI

InChI=1S/C23H32N2O4/c1-5-29-23-14-18(6-8-22(23)28-4)16-24-10-12-25(13-11-24)17-19-15-20(26-2)7-9-21(19)27-3/h6-9,14-15H,5,10-13,16-17H2,1-4H3

InChI Key

LMVYBIYRIDQSLP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02212408

Chemical and Physical Properties

Saltdata

HOOCCOOH

Molecular Weight

400.52

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.747

Distribution Coefficient, logD

1.513

Water Solubility, LogSw

-2.85

Polar Surface Area

37.526

Acid Dissociation Constant (pKa)

28.48

Base Dissociation Constant (pKb)

8.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.80

4092-0849 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Nervous system

References: we are preparing a list of scientific research reports with 4092-0849 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4092-0849?
Check Price and Availability of 4092-0849, 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 4092-0849 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4092-0849
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4092-0849
  • 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 4092-0849 available by request