C875-0118 Screening compound: 2-(2-{[(3-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)-N-(2,3,4-trimethoxyphenyl)acetamide

C875-0118 Screening compound: 2-(2-{[(3-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)-N-(2,3,4-trimethoxyphenyl)acetamide
C875-0118 Screening compound: 2-(2-{[(3-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)-N-(2,3,4-trimethoxyphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C875-0118
2-(2-{[(3-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)-N-(2,3,4-trimethoxyphenyl)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

C875-0118

Molecular Formula

C25H26N4O4S (C25 H26 N4 O4 S)

Compound Name

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

IUPAC name

2-(2-{[(3-methylphenyl)methyl]sulfanyl}-3H-imidazo[45-c]pyridin-3-yl)-N-(234-trimethoxyphenyl)acetamide

SMILES

Cc1cccc(CSc2nc(ccnc3)c3n2CC(Nc(ccc(OC)c2OC)c2OC)=O)c1

InChI

InChI=1S/C25H26N4O4S/c1-16-6-5-7-17(12-16)15-34-25-28-18-10-11-26-13-20(18)29(25)14-22(30)27-19-8-9-21(31-2)24(33-4)23(19)32-3/h5-13H,14-15H2,1-4H3,(H,27,30)

InChI Key

HOHXDDFGJUAAAK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14802210

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

478.57

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.559

Distribution Coefficient, logD

4.544

Water Solubility, LogSw

-4.27

Polar Surface Area

65.511

Acid Dissociation Constant (pKa)

9.68

Base Dissociation Constant (pKb)

5.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

C875-0118 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin

References: we are preparing a list of scientific research reports with C875-0118 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C875-0118?
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What is the minimum amount of C875-0118 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C875-0118
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C875-0118
  • 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 C875-0118 available by request