5554-1215 Screening compound: 1,1-bis[2-oxo-2-({1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl}oxy)ethyl]piperidin-1-ium

5554-1215 Screening compound: 1,1-bis[2-oxo-2-({1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl}oxy)ethyl]piperidin-1-ium
5554-1215 Screening compound: 1,1-bis[2-oxo-2-({1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl}oxy)ethyl]piperidin-1-ium alternative view

Chemical Structure Depiction of ChemDiv screening compound 5554-1215
1,1-bis[2-oxo-2-({1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl}oxy)ethyl]piperidin-1-ium

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

5554-1215

Molecular Formula

C29H48NO4 (C29 H48 NO4)

Compound Name

1,1-bis[2-oxo-2-({1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl}oxy)ethyl]piperidin-1-ium

IUPAC name

11-bis[2-oxo-2-({177-trimethylbicyclo[2.2.1]heptan-2-yl}oxy)ethyl]piperidin-1-ium

SMILES

CC(C)(C(CC1)C2)C1(C)C2OC(C[N+]1(CC(OC2C(C)(CC3)C(C)(C)C3C2)=O)CCCCC1)=O

InChI

InChI=1S/C29H48NO4/c1-26(2)20-10-12-28(26,5)22(16-20)33-24(31)18-30(14-8-7-9-15-30)19-25(32)34-23-17-21-11-13-29(23,6)27(21,3)4/h20-23H,7-19H2,1-6H3/q+1

InChI Key

CAFLOWWGYFEBFJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02058020

Chemical and Physical Properties

Saltdata

Cl-

Molecular Weight

474.7

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.661

Distribution Coefficient, logD

6.661

Water Solubility, LogSw

-5.39

Polar Surface Area

41.599

Acid Dissociation Constant (pKa)

24.43

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

6.00

Percent sp3 carbon bonding

93.10

5554-1215 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with 5554-1215 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5554-1215?
Check Price and Availability of 5554-1215, 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 5554-1215 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5554-1215
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5554-1215
  • 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 5554-1215 available by request