G856-3456 Screening compound: N-{2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]ethyl}-N'-(1-phenylethyl)ethanediamide

G856-3456 Screening compound: N-{2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]ethyl}-N'-(1-phenylethyl)ethanediamide
G856-3456 Screening compound: N-{2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]ethyl}-N'-(1-phenylethyl)ethanediamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G856-3456
N-{2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]ethyl}-N'-(1-phenylethyl)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

G856-3456

Molecular Formula

C21H20FN3O2S (C21 H20 FN3 O2 S)

Compound Name

N-{2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]ethyl}-N'-(1-phenylethyl)ethanediamide

IUPAC name

N-{2-[2-(4-fluorophenyl)-13-thiazol-4-yl]ethyl}-N'-(1-phenylethyl)ethanediamide

SMILES

CC(c1ccccc1)NC(C(NCCc1csc(-c(cc2)ccc2F)n1)=O)=O

InChI

InChI=1S/C21H20FN3O2S/c1-14(15-5-3-2-4-6-15)24-20(27)19(26)23-12-11-18-13-28-21(25-18)16-7-9-17(22)10-8-16/h2-10,13-14H,11-12H2,1H3,(H,23,26)(H,24,27)/t14-/m0/s1

InChI Key

YABMJGSFPIBHBK-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD07193367

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

397.47

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.502

Distribution Coefficient, logD

3.469

Water Solubility, LogSw

-3.83

Polar Surface Area

58.570

Acid Dissociation Constant (pKa)

8.50

Base Dissociation Constant (pKb)

2.55

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

19.00

G856-3456 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

MCL1 Targeted Library (12200 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic

References: we are preparing a list of scientific research reports with G856-3456 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G856-3456?
Check Price and Availability of G856-3456, 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 G856-3456 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G856-3456
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G856-3456
  • 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 G856-3456 available by request