3393-0163 Screening compound: 4-ethyl-3-(pyridin-3-yl)-4,5-dihydro-1H-1,2,4-triazole-5-thione

3393-0163 Screening compound: 4-ethyl-3-(pyridin-3-yl)-4,5-dihydro-1H-1,2,4-triazole-5-thione
3393-0163 Screening compound: 4-ethyl-3-(pyridin-3-yl)-4,5-dihydro-1H-1,2,4-triazole-5-thione alternative view

Chemical Structure Depiction of ChemDiv screening compound 3393-0163
4-ethyl-3-(pyridin-3-yl)-4,5-dihydro-1H-1,2,4-triazole-5-thione

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

3393-0163

Molecular Formula

C9H10N4S (C9 H10 N4 S)

Compound Name

4-ethyl-3-(pyridin-3-yl)-4,5-dihydro-1H-1,2,4-triazole-5-thione

IUPAC name

4-ethyl-3-(pyridin-3-yl)-45-dihydro-1H-124-triazole-5-thione

SMILES

CCN(C(c1cnccc1)=NN1)C1=S

InChI

InChI=1S/C9H10N4S/c1-2-13-8(11-12-9(13)14)7-4-3-5-10-6-7/h3-6H,2H2,1H3,(H,12,14)

InChI Key

NCPZCRVLFQRVRR-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

206.27

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.382

Distribution Coefficient, logD

0.615

Water Solubility, LogSw

-1.17

Polar Surface Area

37.099

Acid Dissociation Constant (pKa)

6.72

Base Dissociation Constant (pKb)

5.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

References: we are preparing a list of scientific research reports with 3393-0163 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3393-0163?
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What is the minimum amount of 3393-0163 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3393-0163
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3393-0163
  • 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 3393-0163 available by request