D731-0421 Screening compound: 2-[5-methyl-1-(2-methylphenyl)-1H-1,2,3-triazol-4-yl]-5-phenyl-1,3,4-oxadiazole

D731-0421 Screening compound: 2-[5-methyl-1-(2-methylphenyl)-1H-1,2,3-triazol-4-yl]-5-phenyl-1,3,4-oxadiazole
D731-0421 Screening compound: 2-[5-methyl-1-(2-methylphenyl)-1H-1,2,3-triazol-4-yl]-5-phenyl-1,3,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound D731-0421
2-[5-methyl-1-(2-methylphenyl)-1H-1,2,3-triazol-4-yl]-5-phenyl-1,3,4-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

D731-0421

Molecular Formula

C18H15N5O (C18 H15 N5 O)

Compound Name

2-[5-methyl-1-(2-methylphenyl)-1H-1,2,3-triazol-4-yl]-5-phenyl-1,3,4-oxadiazole

IUPAC name

2-[5-methyl-1-(2-methylphenyl)-1H-123-triazol-4-yl]-5-phenyl-134-oxadiazole

SMILES

Cc1c(-c2nnc(-c3ccccc3)o2)nnn1-c1c(C)cccc1

InChI

InChI=1S/C18H15N5O/c1-12-8-6-7-11-15(12)23-13(2)16(19-22-23)18-21-20-17(24-18)14-9-4-3-5-10-14/h3-11H,1-2H3

InChI Key

LWZTULCXQHAWGO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09874230

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

317.35

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.247

Distribution Coefficient, logD

3.247

Water Solubility, LogSw

-3.41

Polar Surface Area

57.025

Acid Dissociation Constant (pKa)

22.19

Base Dissociation Constant (pKb)

0.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

References: we are preparing a list of scientific research reports with D731-0421 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D731-0421?
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What is the minimum amount of D731-0421 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D731-0421
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D731-0421
  • 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 D731-0421 available by request