C331-1433 Screening compound: 2-{[5-(4-chlorophenyl)-2-(3,4,5-trimethoxyphenyl)-1H-imidazol-4-yl]sulfanyl}-N-(2-methoxyethyl)acetamide

C331-1433 Screening compound: 2-{[5-(4-chlorophenyl)-2-(3,4,5-trimethoxyphenyl)-1H-imidazol-4-yl]sulfanyl}-N-(2-methoxyethyl)acetamide
C331-1433 Screening compound: 2-{[5-(4-chlorophenyl)-2-(3,4,5-trimethoxyphenyl)-1H-imidazol-4-yl]sulfanyl}-N-(2-methoxyethyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C331-1433
2-{[5-(4-chlorophenyl)-2-(3,4,5-trimethoxyphenyl)-1H-imidazol-4-yl]sulfanyl}-N-(2-methoxyethyl)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

C331-1433

Molecular Formula

C23H26ClN3O5S (C23 H26 ClN3 O5 S)

Compound Name

2-{[5-(4-chlorophenyl)-2-(3,4,5-trimethoxyphenyl)-1H-imidazol-4-yl]sulfanyl}-N-(2-methoxyethyl)acetamide

IUPAC name

2-{[5-(4-chlorophenyl)-2-(345-trimethoxyphenyl)-1H-imidazol-4-yl]sulfanyl}-N-(2-methoxyethyl)acetamide

SMILES

COCCNC(CSc1c(-c(cc2)ccc2Cl)[nH]c(-c(cc2OC)cc(OC)c2OC)n1)=O

InChI

InChI=1S/C23H26ClN3O5S/c1-29-10-9-25-19(28)13-33-23-20(14-5-7-16(24)8-6-14)26-22(27-23)15-11-17(30-2)21(32-4)18(12-15)31-3/h5-8,11-12H,9-10,13H2,1-4H3,(H,25,28)(H,26,27)

InChI Key

GDRLDZVEQASAST-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14749300

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

492

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.940

Distribution Coefficient, logD

3.776

Water Solubility, LogSw

-4.48

Polar Surface Area

75.820

Acid Dissociation Constant (pKa)

5.51

Base Dissociation Constant (pKb)

7.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

C331-1433 in Drug Discovery

Included in Screening Libraries

Human Kinases Annotated Library (2415 compounds)

Human Proteases Annotated Library (2868 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C331-1433 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C331-1433?
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What is the minimum amount of C331-1433 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C331-1433
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C331-1433
  • 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 C331-1433 available by request