G008-4141 Screening compound: 2,3-dihydro-1H-imidazo[1,2-a][1,3]benzimidazol-1-yl [5-(3-methyl-5-isoxazolyl)-2-thienyl] sulfone

G008-4141 Screening compound: 2,3-dihydro-1H-imidazo[1,2-a][1,3]benzimidazol-1-yl [5-(3-methyl-5-isoxazolyl)-2-thienyl] sulfone
G008-4141 Screening compound: 2,3-dihydro-1H-imidazo[1,2-a][1,3]benzimidazol-1-yl [5-(3-methyl-5-isoxazolyl)-2-thienyl] sulfone alternative view

Chemical Structure Depiction of ChemDiv screening compound G008-4141
2,3-dihydro-1H-imidazo[1,2-a][1,3]benzimidazol-1-yl [5-(3-methyl-5-isoxazolyl)-2-thienyl] sulfone

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

G008-4141

Molecular Formula

C17H14N4O3S2 (C17 H14 N4 O3 S2)

Compound Name

2,3-dihydro-1H-imidazo[1,2-a][1,3]benzimidazol-1-yl [5-(3-methyl-5-isoxazolyl)-2-thienyl] sulfone

IUPAC name

5-{[5-(3-methyl-12-oxazol-5-yl)thiophen-2-yl]sulfonyl}-257-triazatricyclo[6.4.0.0^{26}]dodeca-1(8)6911-tetraene

SMILES

Cc1noc(-c(s2)ccc2S(N2c3nc(cccc4)c4n3CC2)(=O)=O)c1

InChI

InChI=1S/C17H14N4O3S2/c1-11-10-14(24-19-11)15-6-7-16(25-15)26(22,23)21-9-8-20-13-5-3-2-4-12(13)18-17(20)21/h2-7,10H,8-9H2,1H3

InChI Key

KORJQVIEVIHCHU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14975851

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.46

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.593

Distribution Coefficient, logD

2.735

Water Solubility, LogSw

-3.61

Polar Surface Area

64.044

Acid Dissociation Constant (pKa)

21.83

Base Dissociation Constant (pKb)

8.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

G008-4141 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

DGK Inhibitors Library (10558 compounds)

Nucleic Acid Ligands (8311 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Kinases
  • Others
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with G008-4141 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G008-4141?
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What is the minimum amount of G008-4141 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G008-4141
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G008-4141
  • 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 G008-4141 available by request