T742-0065 Screening compound: 3-[(1H-imidazol-1-yl)methyl]-5-(2-methoxyphenyl)-1,2,4-oxadiazole

T742-0065 Screening compound: 3-[(1H-imidazol-1-yl)methyl]-5-(2-methoxyphenyl)-1,2,4-oxadiazole
T742-0065 Screening compound: 3-[(1H-imidazol-1-yl)methyl]-5-(2-methoxyphenyl)-1,2,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound T742-0065
3-[(1H-imidazol-1-yl)methyl]-5-(2-methoxyphenyl)-1,2,4-oxadiazole

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

T742-0065

Molecular Formula

C13H12N4O2 (C13 H12 N4 O2)

Compound Name

3-[(1H-imidazol-1-yl)methyl]-5-(2-methoxyphenyl)-1,2,4-oxadiazole

IUPAC name

3-[(1H-imidazol-1-yl)methyl]-5-(2-methoxyphenyl)-124-oxadiazole

SMILES

COc(cccc1)c1-c1nc(Cn2cncc2)no1

InChI

InChI=1S/C13H12N4O2/c1-18-11-5-3-2-4-10(11)13-15-12(16-19-13)8-17-7-6-14-9-17/h2-7,9H,8H2,1H3

InChI Key

ZFVLTISRLSYMCY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27623097

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

256.26

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.397

Distribution Coefficient, logD

-0.006

Water Solubility, LogSw

-2.01

Polar Surface Area

53.087

Acid Dissociation Constant (pKa)

28.78

Base Dissociation Constant (pKb)

8.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

T742-0065 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with T742-0065 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T742-0065?
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What is the minimum amount of T742-0065 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T742-0065
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T742-0065
  • 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 T742-0065 available by request