D718-0365 Screening compound: 6-(4-methoxyphenyl)-2-(methylsulfanyl)-5H,6H,7H,8H-[1,2,4]triazolo[3,2-b]quinazolin-8-one

D718-0365 Screening compound: 6-(4-methoxyphenyl)-2-(methylsulfanyl)-5H,6H,7H,8H-[1,2,4]triazolo[3,2-b]quinazolin-8-one
D718-0365 Screening compound: 6-(4-methoxyphenyl)-2-(methylsulfanyl)-5H,6H,7H,8H-[1,2,4]triazolo[3,2-b]quinazolin-8-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D718-0365
6-(4-methoxyphenyl)-2-(methylsulfanyl)-5H,6H,7H,8H-[1,2,4]triazolo[3,2-b]quinazolin-8-one

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

D718-0365

Molecular Formula

C17H16N4O2S (C17 H16 N4 O2 S)

Compound Name

6-(4-methoxyphenyl)-2-(methylsulfanyl)-5H,6H,7H,8H-[1,2,4]triazolo[3,2-b]quinazolin-8-one

IUPAC name

6-(4-methoxyphenyl)-2-(methylsulfanyl)-5H6H7H8H-[124]triazolo[32-b]quinazolin-8-one

SMILES

COc1ccc(C(Cc2nc3nc(SC)nn3cc22)CC2=O)cc1

InChI

InChI=1S/C17H16N4O2S/c1-23-12-5-3-10(4-6-12)11-7-14-13(15(22)8-11)9-21-16(18-14)19-17(20-21)24-2/h3-6,9,11H,7-8H2,1-2H3/t11-/m1/s1

InChI Key

RHQQNZYPZMFZLC-LLVKDONJSA-N

MDL Number (MFCD)

MFCD09765749

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

340.41

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.668

Distribution Coefficient, logD

2.668

Water Solubility, LogSw

-2.83

Polar Surface Area

53.936

Acid Dissociation Constant (pKa)

18.43

Base Dissociation Constant (pKb)

1.12

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

29.40

References: we are preparing a list of scientific research reports with D718-0365 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D718-0365?
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What is the minimum amount of D718-0365 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D718-0365
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D718-0365
  • 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 D718-0365 available by request