4128-2319 Screening compound: N-[4-(1-ethyl-1H-1,3-benzodiazol-2-yl)-1,2,5-oxadiazol-3-yl]benzamide

4128-2319 Screening compound: N-[4-(1-ethyl-1H-1,3-benzodiazol-2-yl)-1,2,5-oxadiazol-3-yl]benzamide
4128-2319 Screening compound: N-[4-(1-ethyl-1H-1,3-benzodiazol-2-yl)-1,2,5-oxadiazol-3-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4128-2319
N-[4-(1-ethyl-1H-1,3-benzodiazol-2-yl)-1,2,5-oxadiazol-3-yl]benzamide

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

4128-2319

Molecular Formula

C18H15N5O2 (C18 H15 N5 O2)

Compound Name

N-[4-(1-ethyl-1H-1,3-benzodiazol-2-yl)-1,2,5-oxadiazol-3-yl]benzamide

IUPAC name

N-[4-(1-ethyl-1H-13-benzodiazol-2-yl)-125-oxadiazol-3-yl]benzamide

SMILES

CCn1c(-c2nonc2NC(c2ccccc2)=O)nc2c1cccc2

InChI

InChI=1S/C18H15N5O2/c1-2-23-14-11-7-6-10-13(14)19-17(23)15-16(22-25-21-15)20-18(24)12-8-4-3-5-9-12/h3-11H,2H2,1H3,(H,20,22,24)

InChI Key

YPMPSHGGVFLOAC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02934054

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

333.35

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.977

Distribution Coefficient, logD

3.545

Water Solubility, LogSw

-4.02

Polar Surface Area

70.011

Acid Dissociation Constant (pKa)

7.17

Base Dissociation Constant (pKb)

2.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

4128-2319 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with 4128-2319 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4128-2319?
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What is the minimum amount of 4128-2319 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4128-2319
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4128-2319
  • 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 4128-2319 available by request