M114-1446 Screening compound: 1-(4-fluorophenyl)-4-[(3-{[(3-methylphenyl)methyl]sulfanyl}-[1,2,4]triazolo[4,3-a]pyridin-8-yl)sulfonyl]piperazine

M114-1446 Screening compound: 1-(4-fluorophenyl)-4-[(3-{[(3-methylphenyl)methyl]sulfanyl}-[1,2,4]triazolo[4,3-a]pyridin-8-yl)sulfonyl]piperazine
M114-1446 Screening compound: 1-(4-fluorophenyl)-4-[(3-{[(3-methylphenyl)methyl]sulfanyl}-[1,2,4]triazolo[4,3-a]pyridin-8-yl)sulfonyl]piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound M114-1446
1-(4-fluorophenyl)-4-[(3-{[(3-methylphenyl)methyl]sulfanyl}-[1,2,4]triazolo[4,3-a]pyridin-8-yl)sulfonyl]piperazine

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

M114-1446

Molecular Formula

C24H24FN5O2S2 (C24 H24 FN5 O2 S2)

Compound Name

1-(4-fluorophenyl)-4-[(3-{[(3-methylphenyl)methyl]sulfanyl}-[1,2,4]triazolo[4,3-a]pyridin-8-yl)sulfonyl]piperazine

IUPAC name

1-(4-fluorophenyl)-4-[(3-{[(3-methylphenyl)methyl]sulfanyl}-[124]triazolo[43-a]pyridin-8-yl)sulfonyl]piperazine

SMILES

Cc1cccc(CSc2nnc3n2cccc3S(N(CC2)CCN2c(cc2)ccc2F)(=O)=O)c1

InChI

InChI=1S/C24H24FN5O2S2/c1-18-4-2-5-19(16-18)17-33-24-27-26-23-22(6-3-11-30(23)24)34(31,32)29-14-12-28(13-15-29)21-9-7-20(25)8-10-21/h2-11,16H,12-15,17H2,1H3

InChI Key

IQAZLIQFDNDACM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27497584

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

497.62

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.173

Distribution Coefficient, logD

4.173

Water Solubility, LogSw

-4.21

Polar Surface Area

57.677

Acid Dissociation Constant (pKa)

23.69

Base Dissociation Constant (pKb)

1.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with M114-1446 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M114-1446?
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What is the minimum amount of M114-1446 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M114-1446
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M114-1446
  • 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 M114-1446 available by request