G856-4477 Screening compound: N-[2-(4-fluorobenzenesulfonyl)-2-(thiophen-2-yl)ethyl]-3,3-dimethylbutanamide

G856-4477 Screening compound: N-[2-(4-fluorobenzenesulfonyl)-2-(thiophen-2-yl)ethyl]-3,3-dimethylbutanamide
G856-4477 Screening compound: N-[2-(4-fluorobenzenesulfonyl)-2-(thiophen-2-yl)ethyl]-3,3-dimethylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G856-4477
N-[2-(4-fluorobenzenesulfonyl)-2-(thiophen-2-yl)ethyl]-3,3-dimethylbutanamide

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

G856-4477

Molecular Formula

C18H22FNO3S2 (C18 H22 FNO3 S2)

Compound Name

N-[2-(4-fluorobenzenesulfonyl)-2-(thiophen-2-yl)ethyl]-3,3-dimethylbutanamide

IUPAC name

N-[2-(4-fluorobenzenesulfonyl)-2-(thiophen-2-yl)ethyl]-33-dimethylbutanamide

SMILES

CC(C)(C)CC(NCC(c1cccs1)S(c(cc1)ccc1F)(=O)=O)=O

InChI

InChI=1S/C18H22FNO3S2/c1-18(2,3)11-17(21)20-12-16(15-5-4-10-24-15)25(22,23)14-8-6-13(19)7-9-14/h4-10,16H,11-12H2,1-3H3,(H,20,21)/t16-/m0/s1

InChI Key

SCKUMMABYURKDY-INIZCTEOSA-N

MDL Number (MFCD)

MFCD06748646

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

383.51

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.466

Distribution Coefficient, logD

3.466

Water Solubility, LogSw

-3.71

Polar Surface Area

55.229

Acid Dissociation Constant (pKa)

13.34

Base Dissociation Constant (pKb)

-2.97

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.90

G856-4477 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with G856-4477 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G856-4477?
Check Price and Availability of G856-4477, 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 G856-4477 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G856-4477
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G856-4477
  • 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 G856-4477 available by request