G856-7456 Screening compound: N-[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]cyclohexanecarboxamide

G856-7456 Screening compound: N-[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]cyclohexanecarboxamide
G856-7456 Screening compound: N-[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]cyclohexanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G856-7456
N-[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]cyclohexanecarboxamide

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

G856-7456

Molecular Formula

C17H21FN2O2 (C17 H21 FN2 O2)

Compound Name

N-[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]cyclohexanecarboxamide

IUPAC name

N-[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]cyclohexanecarboxamide

SMILES

O=C(C1CCCCC1)NC(CC1=O)CN1c1cccc(F)c1

InChI

InChI=1S/C17H21FN2O2/c18-13-7-4-8-15(9-13)20-11-14(10-16(20)21)19-17(22)12-5-2-1-3-6-12/h4,7-9,12,14H,1-3,5-6,10-11H2,(H,19,22)/t14-/m1/s1

InChI Key

HSKYZHOTAHNTFH-CQSZACIVSA-N

MDL Number (MFCD)

MFCD06730812

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

304.36

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.571

Distribution Coefficient, logD

2.571

Water Solubility, LogSw

-2.88

Polar Surface Area

41.127

Acid Dissociation Constant (pKa)

14.12

Base Dissociation Constant (pKb)

-2.12

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

52.90

G856-7456 in Drug Discovery

Included in Screening Libraries

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

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G856-7456 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G856-7456?
Check Price and Availability of G856-7456, 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 G856-7456 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G856-7456
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G856-7456
  • 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 G856-7456 available by request