Y080-0782 Screening compound: 2-(1H-1,3-benzodiazol-1-yl)-N-[(thiophen-2-yl)methyl]acetamide

Y080-0782 Screening compound: 2-(1H-1,3-benzodiazol-1-yl)-N-[(thiophen-2-yl)methyl]acetamide
Y080-0782 Screening compound: 2-(1H-1,3-benzodiazol-1-yl)-N-[(thiophen-2-yl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y080-0782
2-(1H-1,3-benzodiazol-1-yl)-N-[(thiophen-2-yl)methyl]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

Y080-0782

Molecular Formula

C14H13N3OS (C14 H13 N3 OS)

Compound Name

2-(1H-1,3-benzodiazol-1-yl)-N-[(thiophen-2-yl)methyl]acetamide

IUPAC name

2-(1H-13-benzodiazol-1-yl)-N-[(thiophen-2-yl)methyl]acetamide

SMILES

O=C(Cn1c(cccc2)c2nc1)NCc1cccs1

InChI

InChI=1S/C14H13N3OS/c18-14(15-8-11-4-3-7-19-11)9-17-10-16-12-5-1-2-6-13(12)17/h1-7,10H,8-9H2,(H,15,18)

InChI Key

OJXNOAXCKFMKJU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08254727

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

271.34

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.006

Distribution Coefficient, logD

1.995

Water Solubility, LogSw

-2.40

Polar Surface Area

35.913

Acid Dissociation Constant (pKa)

13.70

Base Dissociation Constant (pKb)

5.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

Y080-0782 in Drug Discovery

Included in Screening Libraries

STING Agonist Library (5895 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Immune system
  • Nervous system
  • Cardiovascular
Targets:
  • Others
  • Ion Channels

References: we are preparing a list of scientific research reports with Y080-0782 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y080-0782?
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What is the minimum amount of Y080-0782 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y080-0782
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y080-0782
  • 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 Y080-0782 available by request