0884-0001 Screening compound: 1-[4-(2-hydroxy-3-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}propoxy)phenoxy]-3-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}propan-2-ol

0884-0001 Screening compound: 1-[4-(2-hydroxy-3-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}propoxy)phenoxy]-3-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}propan-2-ol
0884-0001 Screening compound: 1-[4-(2-hydroxy-3-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}propoxy)phenoxy]-3-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}propan-2-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound 0884-0001
1-[4-(2-hydroxy-3-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}propoxy)phenoxy]-3-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}propan-2-ol

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

0884-0001

Molecular Formula

C38H50N4O4 (C38 H50 N4 O4)

Compound Name

1-[4-(2-hydroxy-3-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}propoxy)phenoxy]-3-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}propan-2-ol

IUPAC name

1-[4-(2-hydroxy-3-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}propoxy)phenoxy]-3-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}propan-2-ol

SMILES

OC(CN1CCN(C/C=C/c2ccccc2)CC1)COc(cc1)ccc1OCC(CN1CCN(C/C=C/c2ccccc2)CC1)O

InChI

InChI=1S/C38H50N4O4/c43-35(29-41-25-21-39(22-26-41)19-7-13-33-9-3-1-4-10-33)31-45-37-15-17-38(18-16-37)46-32-36(44)30-42-27-23-40(24-28-42)20-8-14-34-11-5-2-6-12-34/h1-18,35-36,43-44H,19-32H2

InChI Key

SEGWBOXPYGSJHJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00612401

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

626.84

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

16.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.902

Distribution Coefficient, logD

4.706

Water Solubility, LogSw

-4.56

Polar Surface Area

62.979

Acid Dissociation Constant (pKa)

16.26

Base Dissociation Constant (pKb)

7.15

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

42.10

0884-0001 in Drug Discovery

Included in Screening Libraries

MCL1 Targeted Library (12200 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with 0884-0001 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0884-0001?
Check Price and Availability of 0884-0001, 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 0884-0001 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0884-0001
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0884-0001
  • 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 0884-0001 available by request