D727-0142 Screening compound: 2-{[3-(thiophen-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]methyl}-2,3-dihydro-1H-isoindole-1,3-dione

D727-0142 Screening compound: 2-{[3-(thiophen-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]methyl}-2,3-dihydro-1H-isoindole-1,3-dione
D727-0142 Screening compound: 2-{[3-(thiophen-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]methyl}-2,3-dihydro-1H-isoindole-1,3-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound D727-0142
2-{[3-(thiophen-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]methyl}-2,3-dihydro-1H-isoindole-1,3-dione

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

D727-0142

Molecular Formula

C16H9N5O2S2 (C16 H9 N5 O2 S2)

Compound Name

2-{[3-(thiophen-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]methyl}-2,3-dihydro-1H-isoindole-1,3-dione

IUPAC name

2-{[3-(thiophen-2-yl)-[124]triazolo[34-b][134]thiadiazol-6-yl]methyl}-23-dihydro-1H-isoindole-13-dione

SMILES

O=C(c1c2cccc1)N(Cc(s1)nn3c1nnc3-c1cccs1)C2=O

InChI

InChI=1S/C16H9N5O2S2/c22-14-9-4-1-2-5-10(9)15(23)20(14)8-12-19-21-13(11-6-3-7-24-11)17-18-16(21)25-12/h1-7H,8H2

InChI Key

DELVAAIAHCDTBY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06792700

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

367.41

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.359

Distribution Coefficient, logD

2.359

Water Solubility, LogSw

-2.86

Polar Surface Area

64.760

Acid Dissociation Constant (pKa)

30.49

Base Dissociation Constant (pKb)

-1.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.30

D727-0142 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with D727-0142 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D727-0142?
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What is the minimum amount of D727-0142 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D727-0142
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D727-0142
  • 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 D727-0142 available by request