C878-0304 Screening compound: N-[2-(diethylamino)ethyl]-4-[({3-[(4-fluorophenyl)methyl]-3H-imidazo[4,5-c]pyridin-2-yl}sulfanyl)methyl]benzamide

C878-0304 Screening compound: N-[2-(diethylamino)ethyl]-4-[({3-[(4-fluorophenyl)methyl]-3H-imidazo[4,5-c]pyridin-2-yl}sulfanyl)methyl]benzamide
C878-0304 Screening compound: N-[2-(diethylamino)ethyl]-4-[({3-[(4-fluorophenyl)methyl]-3H-imidazo[4,5-c]pyridin-2-yl}sulfanyl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C878-0304
N-[2-(diethylamino)ethyl]-4-[({3-[(4-fluorophenyl)methyl]-3H-imidazo[4,5-c]pyridin-2-yl}sulfanyl)methyl]benzamide

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

C878-0304

Molecular Formula

C27H30FN5OS (C27 H30 FN5 OS)

Compound Name

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

IUPAC name

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

SMILES

CCN(CC)CCNC(c1ccc(CSc2nc(ccnc3)c3n2Cc(cc2)ccc2F)cc1)=O

InChI

InChI=1S/C27H30FN5OS/c1-3-32(4-2)16-15-30-26(34)22-9-5-21(6-10-22)19-35-27-31-24-13-14-29-17-25(24)33(27)18-20-7-11-23(28)12-8-20/h5-14,17H,3-4,15-16,18-19H2,1-2H3,(H,30,34)

InChI Key

HDWZTBJYHYIQEO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14802863

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

491.63

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.306

Distribution Coefficient, logD

3.192

Water Solubility, LogSw

-3.83

Polar Surface Area

47.933

Acid Dissociation Constant (pKa)

12.39

Base Dissociation Constant (pKb)

8.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.60

C878-0304 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Nucleic Acid Ligands (8311 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system

References: we are preparing a list of scientific research reports with C878-0304 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C878-0304?
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What is the minimum amount of C878-0304 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C878-0304
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C878-0304
  • 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 C878-0304 available by request