Y080-0342 Screening compound: 1-benzyl-2-[(2-methylpropyl)sulfanyl]-1H-1,3-benzodiazole

Y080-0342 Screening compound: 1-benzyl-2-[(2-methylpropyl)sulfanyl]-1H-1,3-benzodiazole
Y080-0342 Screening compound: 1-benzyl-2-[(2-methylpropyl)sulfanyl]-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound Y080-0342
1-benzyl-2-[(2-methylpropyl)sulfanyl]-1H-1,3-benzodiazole

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

Y080-0342

Molecular Formula

C18H20N2S (C18 H20 N2 S)

Compound Name

1-benzyl-2-[(2-methylpropyl)sulfanyl]-1H-1,3-benzodiazole

IUPAC name

1-benzyl-2-[(2-methylpropyl)sulfanyl]-1H-13-benzodiazole

SMILES

CC(C)CSc1nc(cccc2)c2n1Cc1ccccc1

InChI

InChI=1S/C18H20N2S/c1-14(2)13-21-18-19-16-10-6-7-11-17(16)20(18)12-15-8-4-3-5-9-15/h3-11,14H,12-13H2,1-2H3

InChI Key

HRZXZMUFMLWNDM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00416753

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

296.44

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.509

Distribution Coefficient, logD

5.509

Water Solubility, LogSw

-5.65

Polar Surface Area

10.749

Acid Dissociation Constant (pKa)

22.97

Base Dissociation Constant (pKb)

4.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

Y080-0342 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiparasite Library (23996 compounds)

CORONAVIRUS Library (20774 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Immune system
  • animal
  • Antiviral
  • Infections
  • Immune system
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic
Agro:
  • Agro
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with Y080-0342 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y080-0342?
Check Price and Availability of Y080-0342, 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 Y080-0342 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y080-0342
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y080-0342
  • 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 Y080-0342 available by request