Y080-0784 Screening compound: 2-(1H-1,3-benzodiazol-1-yl)-N-propylacetamide

Y080-0784 Screening compound: 2-(1H-1,3-benzodiazol-1-yl)-N-propylacetamide
Y080-0784 Screening compound: 2-(1H-1,3-benzodiazol-1-yl)-N-propylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y080-0784
2-(1H-1,3-benzodiazol-1-yl)-N-propylacetamide

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

Y080-0784

Molecular Formula

C12H15N3O (C12 H15 N3 O)

Compound Name

2-(1H-1,3-benzodiazol-1-yl)-N-propylacetamide

IUPAC name

2-(1H-13-benzodiazol-1-yl)-N-propylacetamide

SMILES

CCCNC(Cn1c(cccc2)c2nc1)=O

InChI

InChI=1S/C12H15N3O/c1-2-7-13-12(16)8-15-9-14-10-5-3-4-6-11(10)15/h3-6,9H,2,7-8H2,1H3,(H,13,16)

InChI Key

CKXYURBRHSIRFM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD11844274

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

217.27

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

1.098

Distribution Coefficient, logD

1.087

Water Solubility, LogSw

-2.16

Polar Surface Area

35.008

Acid Dissociation Constant (pKa)

15.40

Base Dissociation Constant (pKb)

5.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

Y080-0784 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

STING Agonist Library (5895 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with Y080-0784 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y080-0784?
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What is the minimum amount of Y080-0784 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y080-0784
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y080-0784
  • 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 Y080-0784 available by request