4327-3161 Screening compound: 1H-1,3-benzimidazol-2-yl (1H-1,3-benzimidazol-2-ylmethyl) sulfide

4327-3161 Screening compound: 1H-1,3-benzimidazol-2-yl (1H-1,3-benzimidazol-2-ylmethyl) sulfide
4327-3161 Screening compound: 1H-1,3-benzimidazol-2-yl (1H-1,3-benzimidazol-2-ylmethyl) sulfide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4327-3161
1H-1,3-benzimidazol-2-yl (1H-1,3-benzimidazol-2-ylmethyl) sulfide

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

4327-3161

Molecular Formula

C15H12N4S (C15 H12 N4 S)

Compound Name

1H-1,3-benzimidazol-2-yl (1H-1,3-benzimidazol-2-ylmethyl) sulfide

IUPAC name

n/a

SMILES

C(c1nc(cccc2)c2[nH]1)Sc1nc(cccc2)c2[nH]1

InChI

InChI=1S/C15H12N4S/c1-2-6-11-10(5-1)16-14(17-11)9-20-15-18-12-7-3-4-8-13(12)19-15/h1-8H,9H2,(H,16,17)(H,18,19)

InChI Key

ONMJBLRZULUDFX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00423485

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

280.35

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.283

Distribution Coefficient, logD

3.221

Water Solubility, LogSw

-3.34

Polar Surface Area

38.262

Acid Dissociation Constant (pKa)

13.58

Base Dissociation Constant (pKb)

6.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.67

4327-3161 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 4327-3161 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4327-3161?
Check Price and Availability of 4327-3161, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 4327-3161 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4327-3161
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4327-3161
  • 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 4327-3161 available by request