C875-0168 Screening compound: N-cyclopentyl-2-(2-{[(3-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)butanamide

C875-0168 Screening compound: N-cyclopentyl-2-(2-{[(3-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)butanamide
C875-0168 Screening compound: N-cyclopentyl-2-(2-{[(3-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C875-0168
N-cyclopentyl-2-(2-{[(3-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)butanamide

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

C875-0168

Molecular Formula

C23H28N4OS (C23 H28 N4 OS)

Compound Name

N-cyclopentyl-2-(2-{[(3-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)butanamide

IUPAC name

N-cyclopentyl-2-(2-{[(3-methylphenyl)methyl]sulfanyl}-3H-imidazo[45-c]pyridin-3-yl)butanamide

SMILES

CCC(C(NC1CCCC1)=O)n1c(SCc2cc(C)ccc2)nc2c1cncc2

InChI

InChI=1S/C23H28N4OS/c1-3-20(22(28)25-18-9-4-5-10-18)27-21-14-24-12-11-19(21)26-23(27)29-15-17-8-6-7-16(2)13-17/h6-8,11-14,18,20H,3-5,9-10,15H2,1-2H3,(H,25,28)/t20-/m0/s1

InChI Key

DNFVGUDSUVTECZ-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD14802239

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

408.57

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.219

Distribution Coefficient, logD

5.218

Water Solubility, LogSw

-4.72

Polar Surface Area

45.052

Acid Dissociation Constant (pKa)

15.60

Base Dissociation Constant (pKb)

4.85

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

43.50

C875-0168 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Dark Chemical Matter Library (18430 compounds)

Nucleic Acid Ligands (8311 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Neuropeptide S Library (2850 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system
  • Digestive system
  • Nervous system
Agro:
  • Agro
Structure:
  • Pool
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C875-0168 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C875-0168?
Check Price and Availability of C875-0168, 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 C875-0168 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C875-0168
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C875-0168
  • 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 C875-0168 available by request