G878-0144 Screening compound: 3-[4-(4-ethoxyphenyl)-5-(propan-2-ylsulfanyl)-4H-1,2,4-triazol-3-yl]-1H-indole

G878-0144 Screening compound: 3-[4-(4-ethoxyphenyl)-5-(propan-2-ylsulfanyl)-4H-1,2,4-triazol-3-yl]-1H-indole
G878-0144 Screening compound: 3-[4-(4-ethoxyphenyl)-5-(propan-2-ylsulfanyl)-4H-1,2,4-triazol-3-yl]-1H-indole alternative view

Chemical Structure Depiction of ChemDiv screening compound G878-0144
3-[4-(4-ethoxyphenyl)-5-(propan-2-ylsulfanyl)-4H-1,2,4-triazol-3-yl]-1H-indole

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

G878-0144

Molecular Formula

C21H22N4OS (C21 H22 N4 OS)

Compound Name

3-[4-(4-ethoxyphenyl)-5-(propan-2-ylsulfanyl)-4H-1,2,4-triazol-3-yl]-1H-indole

IUPAC name

3-[4-(4-ethoxyphenyl)-5-(propan-2-ylsulfanyl)-4H-124-triazol-3-yl]-1H-indole

SMILES

CCOc(cc1)ccc1-n1c(SC(C)C)nnc1-c1c[nH]c2c1cccc2

InChI

InChI=1S/C21H22N4OS/c1-4-26-16-11-9-15(10-12-16)25-20(23-24-21(25)27-14(2)3)18-13-22-19-8-6-5-7-17(18)19/h5-14,22H,4H2,1-3H3

InChI Key

ACFHFJWGYDSOEH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05003095

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

378.5

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.209

Distribution Coefficient, logD

5.209

Water Solubility, LogSw

-5.33

Polar Surface Area

41.978

Acid Dissociation Constant (pKa)

18.82

Base Dissociation Constant (pKb)

1.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

References: we are preparing a list of scientific research reports with G878-0144 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G878-0144?
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What is the minimum amount of G878-0144 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G878-0144
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G878-0144
  • 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 G878-0144 available by request