Y080-0268 Screening compound: N-[(1H-1,3-benzodiazol-2-yl)methyl]-N-methylacetamide

Y080-0268 Screening compound: N-[(1H-1,3-benzodiazol-2-yl)methyl]-N-methylacetamide
Y080-0268 Screening compound: N-[(1H-1,3-benzodiazol-2-yl)methyl]-N-methylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y080-0268
N-[(1H-1,3-benzodiazol-2-yl)methyl]-N-methylacetamide

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

Y080-0268

Molecular Formula

C11H13N3O (C11 H13 N3 O)

Compound Name

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

IUPAC name

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

SMILES

CC(N(C)Cc1nc(cccc2)c2[nH]1)=O

InChI

InChI=1S/C11H13N3O/c1-8(15)14(2)7-11-12-9-5-3-4-6-10(9)13-11/h3-6H,7H2,1-2H3,(H,12,13)

InChI Key

MSIPMOPYLXCWEW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD11867911

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

203.24

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.128

Distribution Coefficient, logD

1.128

Water Solubility, LogSw

-1.92

Polar Surface Area

37.410

Acid Dissociation Constant (pKa)

12.34

Base Dissociation Constant (pKb)

4.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

Y080-0268 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Soluble Diversity Library (15920 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Nervous system
  • Nervous system
  • Nervous system
  • Cardiovascular
Mechanism of action:
  • Epigenetic
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with Y080-0268 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y080-0268?
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What is the minimum amount of Y080-0268 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y080-0268
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y080-0268
  • 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 Y080-0268 available by request