C875-0300 Screening compound: N-(4-chloro-2-fluorophenyl)-2-(2-{[(3-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)acetamide

C875-0300 Screening compound: N-(4-chloro-2-fluorophenyl)-2-(2-{[(3-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)acetamide
C875-0300 Screening compound: N-(4-chloro-2-fluorophenyl)-2-(2-{[(3-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C875-0300
N-(4-chloro-2-fluorophenyl)-2-(2-{[(3-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)acetamide

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

C875-0300

Molecular Formula

C21H15ClF2N4OS (C21 H15 ClF2 N4 OS)

Compound Name

N-(4-chloro-2-fluorophenyl)-2-(2-{[(3-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)acetamide

IUPAC name

N-(4-chloro-2-fluorophenyl)-2-(2-{[(3-fluorophenyl)methyl]sulfanyl}-3H-imidazo[45-c]pyridin-3-yl)acetamide

SMILES

O=C(Cn1c(SCc2cc(F)ccc2)nc2c1cncc2)Nc(ccc(Cl)c1)c1F

InChI

InChI=1S/C21H15ClF2N4OS/c22-14-4-5-17(16(24)9-14)26-20(29)11-28-19-10-25-7-6-18(19)27-21(28)30-12-13-2-1-3-15(23)8-13/h1-10H,11-12H2,(H,26,29)

InChI Key

PBEFFHPOCPWEDV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14802312

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

444.89

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.173

Distribution Coefficient, logD

5.140

Water Solubility, LogSw

-5.62

Polar Surface Area

42.447

Acid Dissociation Constant (pKa)

8.74

Base Dissociation Constant (pKb)

5.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.50

C875-0300 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antifungal Library (16415 compounds)

CNS Targets (44014 compounds)

CNS targets activity set (6557 compounds)

Nucleic Acid Ligands (8311 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:
  • Infections
  • Immune system
  • animal
  • Nervous system
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with C875-0300 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C875-0300?
Check Price and Availability of C875-0300, 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 C875-0300 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C875-0300
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C875-0300
  • 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 C875-0300 available by request