F972-0292 Screening compound: 2-[2-(4-acetamidophenyl)ethyl]-N-(3-methoxypropyl)-1H-1,3-benzodiazole-5-carboxamide

F972-0292 Screening compound: 2-[2-(4-acetamidophenyl)ethyl]-N-(3-methoxypropyl)-1H-1,3-benzodiazole-5-carboxamide
F972-0292 Screening compound: 2-[2-(4-acetamidophenyl)ethyl]-N-(3-methoxypropyl)-1H-1,3-benzodiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F972-0292
2-[2-(4-acetamidophenyl)ethyl]-N-(3-methoxypropyl)-1H-1,3-benzodiazole-5-carboxamide

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

F972-0292

Molecular Formula

C22H26N4O3 (C22 H26 N4 O3)

Compound Name

2-[2-(4-acetamidophenyl)ethyl]-N-(3-methoxypropyl)-1H-1,3-benzodiazole-5-carboxamide

IUPAC name

2-[2-(4-acetamidophenyl)ethyl]-N-(3-methoxypropyl)-1H-13-benzodiazole-5-carboxamide

SMILES

CC(Nc1ccc(CCc2nc(cc(cc3)C(NCCCOC)=O)c3[nH]2)cc1)=O

InChI

InChI=1S/C22H26N4O3/c1-15(27)24-18-8-4-16(5-9-18)6-11-21-25-19-10-7-17(14-20(19)26-21)22(28)23-12-3-13-29-2/h4-5,7-10,14H,3,6,11-13H2,1-2H3,(H,23,28)(H,24,27)(H,25,26)

InChI Key

ZADLTNIZYKJVOZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27206360

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

394.47

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.520

Distribution Coefficient, logD

2.516

Water Solubility, LogSw

-2.94

Polar Surface Area

76.379

Acid Dissociation Constant (pKa)

10.80

Base Dissociation Constant (pKb)

5.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

F972-0292 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F972-0292 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F972-0292?
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What is the minimum amount of F972-0292 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F972-0292
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F972-0292
  • 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 F972-0292 available by request