C200-3972 Screening compound: 2-(4-methylphenyl)-5H,6H-[1,2,4]triazolo[1,5-c]quinazoline-5-thione

C200-3972 Screening compound: 2-(4-methylphenyl)-5H,6H-[1,2,4]triazolo[1,5-c]quinazoline-5-thione
C200-3972 Screening compound: 2-(4-methylphenyl)-5H,6H-[1,2,4]triazolo[1,5-c]quinazoline-5-thione alternative view

Chemical Structure Depiction of ChemDiv screening compound C200-3972
2-(4-methylphenyl)-5H,6H-[1,2,4]triazolo[1,5-c]quinazoline-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

C200-3972

Molecular Formula

C16H12N4S (C16 H12 N4 S)

Compound Name

2-(4-methylphenyl)-5H,6H-[1,2,4]triazolo[1,5-c]quinazoline-5-thione

IUPAC name

2-(4-methylphenyl)-5H6H-[124]triazolo[15-c]quinazoline-5-thione

SMILES

Cc(cc1)ccc1-c(nc1-c(cccc2)c2N2)nn1C2=S

InChI

InChI=1S/C16H12N4S/c1-10-6-8-11(9-7-10)14-18-15-12-4-2-3-5-13(12)17-16(21)20(15)19-14/h2-9H,1H3,(H,17,21)

InChI Key

WIAXLTIMRBQUCT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14727139

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

292.36

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.240

Distribution Coefficient, logD

4.240

Water Solubility, LogSw

-4.41

Polar Surface Area

35.146

Acid Dissociation Constant (pKa)

10.52

Base Dissociation Constant (pKb)

1.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.30

C200-3972 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C200-3972 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C200-3972?
Check Price and Availability of C200-3972, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of C200-3972 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C200-3972
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C200-3972
  • 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 C200-3972 available by request