3406-0417 Screening compound: 2,4,6,8-tetrakis(4-methoxyphenyl)-3,7-diazabicyclo[3.3.1]nonan-9-one

3406-0417 Screening compound: 2,4,6,8-tetrakis(4-methoxyphenyl)-3,7-diazabicyclo[3.3.1]nonan-9-one
3406-0417 Screening compound: 2,4,6,8-tetrakis(4-methoxyphenyl)-3,7-diazabicyclo[3.3.1]nonan-9-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3406-0417
2,4,6,8-tetrakis(4-methoxyphenyl)-3,7-diazabicyclo[3.3.1]nonan-9-one

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

3406-0417

Molecular Formula

C35H36N2O5 (C35 H36 N2 O5)

Compound Name

2,4,6,8-tetrakis(4-methoxyphenyl)-3,7-diazabicyclo[3.3.1]nonan-9-one

IUPAC name

2468-tetrakis(4-methoxyphenyl)-37-diazabicyclo[3.3.1]nonan-9-one

SMILES

COc1ccc(C(C(C(c(cc2)ccc2OC)NC(C23)c(cc4)ccc4OC)C2=O)NC3c(cc2)ccc2OC)cc1

InChI

InChI=1S/C35H36N2O5/c1-39-25-13-5-21(6-14-25)31-29-32(22-7-15-26(40-2)16-8-22)37-34(24-11-19-28(42-4)20-12-24)30(35(29)38)33(36-31)23-9-17-27(41-3)18-10-23/h5-20,29-34,36-37H,1-4H3

InChI Key

SJYGOTYPICEFKJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00317737

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

564.68

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.268

Distribution Coefficient, logD

6.268

Water Solubility, LogSw

-5.85

Polar Surface Area

68.306

Acid Dissociation Constant (pKa)

16.14

Base Dissociation Constant (pKb)

4.10

Number of Chiral Centers

4.00

Percent sp3 carbon bonding

28.60

References: we are preparing a list of scientific research reports with 3406-0417 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3406-0417?
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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3406-0417
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3406-0417
  • 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 3406-0417 available by request