4554-1943 Screening compound: 1-[4-(TERT-BUTYL)PHENOXY]-3-[4-(2-METHOXYPHENYL)PIPERAZINO]-2-PROPANOL

4554-1943 Screening compound: 1-[4-(TERT-BUTYL)PHENOXY]-3-[4-(2-METHOXYPHENYL)PIPERAZINO]-2-PROPANOL
4554-1943 Screening compound: 1-[4-(TERT-BUTYL)PHENOXY]-3-[4-(2-METHOXYPHENYL)PIPERAZINO]-2-PROPANOL alternative view

Chemical Structure Depiction of ChemDiv screening compound 4554-1943
1-[4-(TERT-BUTYL)PHENOXY]-3-[4-(2-METHOXYPHENYL)PIPERAZINO]-2-PROPANOL

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

4554-1943

Molecular Formula

C24H34N2O3 (C24 H34 N2 O3)

Compound Name

1-[4-(TERT-BUTYL)PHENOXY]-3-[4-(2-METHOXYPHENYL)PIPERAZINO]-2-PROPANOL

IUPAC name

n/a

SMILES

CC(C)(C)c(cc1)ccc1OCC(CN(CC1)CCN1c(cccc1)c1OC)O

InChI

InChI=1S/C24H34N2O3/c1-24(2,3)19-9-11-21(12-10-19)29-18-20(27)17-25-13-15-26(16-14-25)22-7-5-6-8-23(22)28-4/h5-12,20,27H,13-18H2,1-4H3/t20-/m0/s1

InChI Key

NEDUKXQTWGHTDD-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD03826933

Chemical and Physical Properties

Saltdata

2HCl

Molecular Weight

398.55

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.862

Distribution Coefficient, logD

4.829

Water Solubility, LogSw

-4.46

Polar Surface Area

38.679

Acid Dissociation Constant (pKa)

16.26

Base Dissociation Constant (pKb)

6.29

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

4554-1943 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

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

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Therapeutical areas:
  • Nervous system
Targets:
  • Ion Channels
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with 4554-1943 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4554-1943?
Check Price and Availability of 4554-1943, 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 4554-1943 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4554-1943
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4554-1943
  • 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 4554-1943 available by request