6431-0007 Screening compound: triethyl(3-{[5-methyl-2-(propan-2-yl)cyclohexyl]oxy}propyl)azanium

6431-0007 Screening compound: triethyl(3-{[5-methyl-2-(propan-2-yl)cyclohexyl]oxy}propyl)azanium
6431-0007 Screening compound: triethyl(3-{[5-methyl-2-(propan-2-yl)cyclohexyl]oxy}propyl)azanium alternative view

Chemical Structure Depiction of ChemDiv screening compound 6431-0007
triethyl(3-{[5-methyl-2-(propan-2-yl)cyclohexyl]oxy}propyl)azanium

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

6431-0007

Molecular Formula

C19H40NO (C19 H40 NO)

Compound Name

triethyl(3-{[5-methyl-2-(propan-2-yl)cyclohexyl]oxy}propyl)azanium

IUPAC name

triethyl(3-{[5-methyl-2-(propan-2-yl)cyclohexyl]oxy}propyl)azanium

SMILES

CC[N+](CC)(CC)CCCOC(CC(C)CC1)C1C(C)C

InChI

InChI=1S/C19H40NO/c1-7-20(8-2,9-3)13-10-14-21-19-15-17(6)11-12-18(19)16(4)5/h16-19H,7-15H2,1-6H3/q+1

InChI Key

XIBXXUYZWIKLGL-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

I-

Molecular Weight

298.53

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.232

Distribution Coefficient, logD

5.232

Water Solubility, LogSw

-4.82

Polar Surface Area

7.267

Acid Dissociation Constant (pKa)

26.34

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

100.00

6431-0007 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 6431-0007 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6431-0007?
Check Price and Availability of 6431-0007, 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 6431-0007 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6431-0007
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6431-0007
  • 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 6431-0007 available by request