8206-0017 Screening compound: N-(4-ISOPROPOXYBENZYL)-N-[2-(4-ISOPROPYL-2,2-DIMETHYLTETRAHYDRO-2H-PYRAN-4-YL)ETHYL]AMINE

8206-0017 Screening compound: N-(4-ISOPROPOXYBENZYL)-N-[2-(4-ISOPROPYL-2,2-DIMETHYLTETRAHYDRO-2H-PYRAN-4-YL)ETHYL]AMINE
8206-0017 Screening compound: N-(4-ISOPROPOXYBENZYL)-N-[2-(4-ISOPROPYL-2,2-DIMETHYLTETRAHYDRO-2H-PYRAN-4-YL)ETHYL]AMINE alternative view

Chemical Structure Depiction of ChemDiv screening compound 8206-0017
N-(4-ISOPROPOXYBENZYL)-N-[2-(4-ISOPROPYL-2,2-DIMETHYLTETRAHYDRO-2H-PYRAN-4-YL)ETHYL]AMINE

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

8206-0017

Molecular Formula

C22H37NO2 (C22 H37 NO2)

Compound Name

N-(4-ISOPROPOXYBENZYL)-N-[2-(4-ISOPROPYL-2,2-DIMETHYLTETRAHYDRO-2H-PYRAN-4-YL)ETHYL]AMINE

IUPAC name

n/a

SMILES

CC(C)C1(CCNCc(cc2)ccc2OC(C)C)CC(C)(C)OCC1

InChI

InChI=1S/C22H37NO2/c1-17(2)22(12-14-24-21(5,6)16-22)11-13-23-15-19-7-9-20(10-8-19)25-18(3)4/h7-10,17-18,23H,11-16H2,1-6H3/t22-/m0/s1

InChI Key

YFODDWIUJODQNJ-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD04143656

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

347.54

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.358

Distribution Coefficient, logD

3.633

Water Solubility, LogSw

-4.24

Polar Surface Area

26.039

Acid Dissociation Constant (pKa)

27.31

Base Dissociation Constant (pKb)

8.03

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

19.00

8206-0017 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Protein-Protein Interaction Library (218420 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with 8206-0017 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8206-0017?
Check Price and Availability of 8206-0017, 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 8206-0017 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8206-0017
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8206-0017
  • 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 8206-0017 available by request