8009-4896 Screening compound: dimethyl {9-hydroxy-2,4-diphenyl-3-azabicyclo[3.3.1]nonan-9-yl}phosphonate

8009-4896 Screening compound: dimethyl {9-hydroxy-2,4-diphenyl-3-azabicyclo[3.3.1]nonan-9-yl}phosphonate
8009-4896 Screening compound: dimethyl {9-hydroxy-2,4-diphenyl-3-azabicyclo[3.3.1]nonan-9-yl}phosphonate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8009-4896
dimethyl {9-hydroxy-2,4-diphenyl-3-azabicyclo[3.3.1]nonan-9-yl}phosphonate

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

8009-4896

Molecular Formula

C22H28NO4P (C22 H28 NO4 P)

Compound Name

dimethyl {9-hydroxy-2,4-diphenyl-3-azabicyclo[3.3.1]nonan-9-yl}phosphonate

IUPAC name

dimethyl {9-hydroxy-24-diphenyl-3-azabicyclo[3.3.1]nonan-9-yl}phosphonate

SMILES

COP(C(C1CCC2)(C2C(c2ccccc2)NC1c1ccccc1)O)(OC)=O

InChI

InChI=1S/C22H28NO4P/c1-26-28(25,27-2)22(24)18-14-9-15-19(22)21(17-12-7-4-8-13-17)23-20(18)16-10-5-3-6-11-16/h3-8,10-13,18-21,23-24H,9,14-15H2,1-2H3

InChI Key

FVURVDZRDOAWTJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00349338

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.330

Distribution Coefficient, logD

2.589

Water Solubility, LogSw

-3.36

Polar Surface Area

57.670

Acid Dissociation Constant (pKa)

14.59

Base Dissociation Constant (pKb)

8.05

Number of Chiral Centers

4.00

Percent sp3 carbon bonding

45.50

References: we are preparing a list of scientific research reports with 8009-4896 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8009-4896?
Check Price and Availability of 8009-4896, 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 8009-4896 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8009-4896
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8009-4896
  • 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 8009-4896 available by request