G856-4166 Screening compound: N-[2-(2H-1,3-benzodioxol-5-yl)-2-(4-methylpiperazin-1-yl)ethyl]-2,6-difluorobenzamide

G856-4166 Screening compound: N-[2-(2H-1,3-benzodioxol-5-yl)-2-(4-methylpiperazin-1-yl)ethyl]-2,6-difluorobenzamide
G856-4166 Screening compound: N-[2-(2H-1,3-benzodioxol-5-yl)-2-(4-methylpiperazin-1-yl)ethyl]-2,6-difluorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G856-4166
N-[2-(2H-1,3-benzodioxol-5-yl)-2-(4-methylpiperazin-1-yl)ethyl]-2,6-difluorobenzamide

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

G856-4166

Molecular Formula

C21H23F2N3O3 (C21 H23 F2 N3 O3)

Compound Name

N-[2-(2H-1,3-benzodioxol-5-yl)-2-(4-methylpiperazin-1-yl)ethyl]-2,6-difluorobenzamide

IUPAC name

N-[2-(2H-13-benzodioxol-5-yl)-2-(4-methylpiperazin-1-yl)ethyl]-26-difluorobenzamide

SMILES

CN(CC1)CCN1C(CNC(c(c(F)ccc1)c1F)=O)c(cc1)cc2c1OCO2

InChI

InChI=1S/C21H23F2N3O3/c1-25-7-9-26(10-8-25)17(14-5-6-18-19(11-14)29-13-28-18)12-24-21(27)20-15(22)3-2-4-16(20)23/h2-6,11,17H,7-10,12-13H2,1H3,(H,24,27)/t17-/m0/s1

InChI Key

RUQOIRPIKHMHJM-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD07192634

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

403.43

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.467

Distribution Coefficient, logD

2.094

Water Solubility, LogSw

-2.99

Polar Surface Area

48.233

Acid Dissociation Constant (pKa)

9.87

Base Dissociation Constant (pKb)

7.53

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.10

References: we are preparing a list of scientific research reports with G856-4166 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G856-4166?
Check Price and Availability of G856-4166, 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 G856-4166 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G856-4166
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G856-4166
  • 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 G856-4166 available by request