8004-6245 Screening compound: N-(2-ethylhexyl)-N'-(3-methylphenyl)ethanediamide

8004-6245 Screening compound: N-(2-ethylhexyl)-N'-(3-methylphenyl)ethanediamide
8004-6245 Screening compound: N-(2-ethylhexyl)-N'-(3-methylphenyl)ethanediamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8004-6245
N-(2-ethylhexyl)-N'-(3-methylphenyl)ethanediamide

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

8004-6245

Molecular Formula

C17H26N2O2 (C17 H26 N2 O2)

Compound Name

N-(2-ethylhexyl)-N'-(3-methylphenyl)ethanediamide

IUPAC name

N-(2-ethylhexyl)-N'-(3-methylphenyl)ethanediamide

SMILES

CCCCC(CC)CNC(C(Nc1cc(C)ccc1)=O)=O

InChI

InChI=1S/C17H26N2O2/c1-4-6-9-14(5-2)12-18-16(20)17(21)19-15-10-7-8-13(3)11-15/h7-8,10-11,14H,4-6,9,12H2,1-3H3,(H,18,20)(H,19,21)/t14-/m0/s1

InChI Key

NRUFSNVHPSVWDR-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD00739882

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

290.41

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.214

Distribution Coefficient, logD

4.150

Water Solubility, LogSw

-4.30

Polar Surface Area

48.286

Acid Dissociation Constant (pKa)

8.20

Base Dissociation Constant (pKb)

-0.00

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

52.90

References: we are preparing a list of scientific research reports with 8004-6245 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8004-6245?
Check Price and Availability of 8004-6245, 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 8004-6245 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8004-6245
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8004-6245
  • 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 8004-6245 available by request