C797-0537 Screening compound: ethyl 2-(2-{[3-(trifluoromethyl)benzyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)acetate

C797-0537 Screening compound: ethyl 2-(2-{[3-(trifluoromethyl)benzyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)acetate
C797-0537 Screening compound: ethyl 2-(2-{[3-(trifluoromethyl)benzyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound C797-0537
ethyl 2-(2-{[3-(trifluoromethyl)benzyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)acetate

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

C797-0537

Molecular Formula

C18H16F3N3O2S (C18 H16 F3 N3 O2 S)

Compound Name

ethyl 2-(2-{[3-(trifluoromethyl)benzyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)acetate

IUPAC name

n/a

SMILES

CCOC(Cn1c(SCc2cc(C(F)(F)F)ccc2)nc2c1cncc2)=O

InChI

InChI=1S/C18H16F3N3O2S/c1-2-26-16(25)10-24-15-9-22-7-6-14(15)23-17(24)27-11-12-4-3-5-13(8-12)18(19,20)21/h3-9H,2,10-11H2,1H3

InChI Key

SKMMGXHLNFXNST-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14798169

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.205

Distribution Coefficient, logD

4.176

Water Solubility, LogSw

-4.11

Polar Surface Area

40.426

Acid Dissociation Constant (pKa)

18.39

Base Dissociation Constant (pKb)

6.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

C797-0537 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with C797-0537 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C797-0537?
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What is the minimum amount of C797-0537 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C797-0537
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C797-0537
  • 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 C797-0537 available by request