D423-0024 Screening compound: 3-(4-methoxyphenyl)-5-[(2-methylprop-2-en-1-yl)sulfanyl]-4-phenyl-4H-1,2,4-triazole

D423-0024 Screening compound: 3-(4-methoxyphenyl)-5-[(2-methylprop-2-en-1-yl)sulfanyl]-4-phenyl-4H-1,2,4-triazole
D423-0024 Screening compound: 3-(4-methoxyphenyl)-5-[(2-methylprop-2-en-1-yl)sulfanyl]-4-phenyl-4H-1,2,4-triazole alternative view

Chemical Structure Depiction of ChemDiv screening compound D423-0024
3-(4-methoxyphenyl)-5-[(2-methylprop-2-en-1-yl)sulfanyl]-4-phenyl-4H-1,2,4-triazole

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

D423-0024

Molecular Formula

C19H19N3OS (C19 H19 N3 OS)

Compound Name

3-(4-methoxyphenyl)-5-[(2-methylprop-2-en-1-yl)sulfanyl]-4-phenyl-4H-1,2,4-triazole

IUPAC name

3-(4-methoxyphenyl)-5-[(2-methylprop-2-en-1-yl)sulfanyl]-4-phenyl-4H-124-triazole

SMILES

CC(CSc1nnc(-c(cc2)ccc2OC)n1-c1ccccc1)=C

InChI

InChI=1S/C19H19N3OS/c1-14(2)13-24-19-21-20-18(15-9-11-17(23-3)12-10-15)22(19)16-7-5-4-6-8-16/h4-12H,1,13H2,2-3H3

InChI Key

GYJOYBRTSQCCRZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04767718

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

337.45

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.926

Distribution Coefficient, logD

4.926

Water Solubility, LogSw

-4.66

Polar Surface Area

32.528

Acid Dissociation Constant (pKa)

29.72

Base Dissociation Constant (pKb)

0.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

D423-0024 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D423-0024 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D423-0024?
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What is the minimum amount of D423-0024 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D423-0024
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D423-0024
  • 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 D423-0024 available by request