5504-0115 Screening compound: benzyl[2-(4-chlorophenyl)-2-oxoethyl]dimethylazanium

5504-0115 Screening compound: benzyl[2-(4-chlorophenyl)-2-oxoethyl]dimethylazanium
5504-0115 Screening compound: benzyl[2-(4-chlorophenyl)-2-oxoethyl]dimethylazanium alternative view

Chemical Structure Depiction of ChemDiv screening compound 5504-0115
benzyl[2-(4-chlorophenyl)-2-oxoethyl]dimethylazanium

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

5504-0115

Molecular Formula

C17H19ClNO (C17 H19 ClNO)

Compound Name

benzyl[2-(4-chlorophenyl)-2-oxoethyl]dimethylazanium

IUPAC name

benzyl[2-(4-chlorophenyl)-2-oxoethyl]dimethylazanium

SMILES

C[N+](C)(CC(c(cc1)ccc1Cl)=O)Cc1ccccc1

InChI

InChI=1S/C17H19ClNO/c1-19(2,12-14-6-4-3-5-7-14)13-17(20)15-8-10-16(18)11-9-15/h3-11H,12-13H2,1-2H3/q+1

InChI Key

YCXYYVQMLWTAKS-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

Cl-

Molecular Weight

288.8

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

3.520

Distribution Coefficient, logD

3.520

Water Solubility, LogSw

-4.08

Polar Surface Area

13.570

Acid Dissociation Constant (pKa)

20.39

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

References: we are preparing a list of scientific research reports with 5504-0115 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5504-0115?
Check Price and Availability of 5504-0115, 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 5504-0115 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5504-0115
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5504-0115
  • 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 5504-0115 available by request