G125-0849 Screening compound: N-[(4-fluorophenyl)methyl]-1-[5-(1H-indol-1-yl)thiophene-2-carbonyl]piperidine-4-carboxamide

G125-0849 Screening compound: N-[(4-fluorophenyl)methyl]-1-[5-(1H-indol-1-yl)thiophene-2-carbonyl]piperidine-4-carboxamide
G125-0849 Screening compound: N-[(4-fluorophenyl)methyl]-1-[5-(1H-indol-1-yl)thiophene-2-carbonyl]piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G125-0849
N-[(4-fluorophenyl)methyl]-1-[5-(1H-indol-1-yl)thiophene-2-carbonyl]piperidine-4-carboxamide

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

G125-0849

Molecular Formula

C26H24FN3O2S (C26 H24 FN3 O2 S)

Compound Name

N-[(4-fluorophenyl)methyl]-1-[5-(1H-indol-1-yl)thiophene-2-carbonyl]piperidine-4-carboxamide

IUPAC name

N-[(4-fluorophenyl)methyl]-1-[5-(1H-indol-1-yl)thiophene-2-carbonyl]piperidine-4-carboxamide

SMILES

O=C(C(CC1)CCN1C(c1ccc(-n(cc2)c3c2cccc3)s1)=O)NCc(cc1)ccc1F

InChI

InChI=1S/C26H24FN3O2S/c27-21-7-5-18(6-8-21)17-28-25(31)20-11-14-29(15-12-20)26(32)23-9-10-24(33-23)30-16-13-19-3-1-2-4-22(19)30/h1-10,13,16,20H,11-12,14-15,17H2,(H,28,31)

InChI Key

CNKCEIACWKBJER-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14982725

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

461.56

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.573

Distribution Coefficient, logD

4.573

Water Solubility, LogSw

-4.54

Polar Surface Area

44.968

Acid Dissociation Constant (pKa)

12.14

Base Dissociation Constant (pKb)

7.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

G125-0849 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Annotated Library (21441 compounds)

CORONAVIRUS Library (20774 compounds)

PLpro Library (6343 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with G125-0849 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G125-0849?
Check Price and Availability of G125-0849, 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 G125-0849 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G125-0849
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G125-0849
  • 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 G125-0849 available by request