4928-0023 Screening compound: 1-[2,4-bis(2-methylbutan-2-yl)phenoxy]-3-(4-phenylpiperazin-1-yl)propan-2-ol

4928-0023 Screening compound: 1-[2,4-bis(2-methylbutan-2-yl)phenoxy]-3-(4-phenylpiperazin-1-yl)propan-2-ol
4928-0023 Screening compound: 1-[2,4-bis(2-methylbutan-2-yl)phenoxy]-3-(4-phenylpiperazin-1-yl)propan-2-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound 4928-0023
1-[2,4-bis(2-methylbutan-2-yl)phenoxy]-3-(4-phenylpiperazin-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

4928-0023

Molecular Formula

C29H44N2O2 (C29 H44 N2 O2)

Compound Name

1-[2,4-bis(2-methylbutan-2-yl)phenoxy]-3-(4-phenylpiperazin-1-yl)propan-2-ol

IUPAC name

1-[24-bis(2-methylbutan-2-yl)phenoxy]-3-(4-phenylpiperazin-1-yl)propan-2-ol

SMILES

CCC(C)(C)c(cc1)cc(C(C)(C)CC)c1OCC(CN(CC1)CCN1c1ccccc1)O

InChI

InChI=1S/C29H44N2O2/c1-7-28(3,4)23-14-15-27(26(20-23)29(5,6)8-2)33-22-25(32)21-30-16-18-31(19-17-30)24-12-10-9-11-13-24/h9-15,20,25,32H,7-8,16-19,21-22H2,1-6H3/t25-/m0/s1

InChI Key

RELFMXVEHMESRO-VWLOTQADSA-N

MDL Number (MFCD)

MFCD03448156

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

452.68

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

7.189

Distribution Coefficient, logD

7.130

Water Solubility, LogSw

-5.77

Polar Surface Area

31.437

Acid Dissociation Constant (pKa)

16.26

Base Dissociation Constant (pKb)

6.56

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

58.60

4928-0023 in Drug Discovery

Included in Screening Libraries

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

MCE-18 Trends in Medicinal Chemistry (51288 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 4928-0023 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4928-0023?
Check Price and Availability of 4928-0023, 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 4928-0023 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4928-0023
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4928-0023
  • 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 4928-0023 available by request