C718-2659 Screening compound: 1-[3-(4-bromobenzenesulfonyl)-[1,2,3]triazolo[1,5-a]quinazolin-5-yl]-4-phenylpiperazine

C718-2659 Screening compound: 1-[3-(4-bromobenzenesulfonyl)-[1,2,3]triazolo[1,5-a]quinazolin-5-yl]-4-phenylpiperazine
C718-2659 Screening compound: 1-[3-(4-bromobenzenesulfonyl)-[1,2,3]triazolo[1,5-a]quinazolin-5-yl]-4-phenylpiperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound C718-2659
1-[3-(4-bromobenzenesulfonyl)-[1,2,3]triazolo[1,5-a]quinazolin-5-yl]-4-phenylpiperazine

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

C718-2659

Molecular Formula

C25H21BrN6O2S (C25 H21 BrN6 O2 S)

Compound Name

1-[3-(4-bromobenzenesulfonyl)-[1,2,3]triazolo[1,5-a]quinazolin-5-yl]-4-phenylpiperazine

IUPAC name

1-[3-(4-bromobenzenesulfonyl)-[123]triazolo[15-a]quinazolin-5-yl]-4-phenylpiperazine

SMILES

O=S(c(nnn1c2c3cccc2)c1nc3N(CC1)CCN1c1ccccc1)(c(cc1)ccc1Br)=O

InChI

InChI=1S/C25H21BrN6O2S/c26-18-10-12-20(13-11-18)35(33,34)25-24-27-23(21-8-4-5-9-22(21)32(24)29-28-25)31-16-14-30(15-17-31)19-6-2-1-3-7-19/h1-13H,14-17H2

InChI Key

ZDKPIHHJZHQWSO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08568824

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

549.45

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.678

Distribution Coefficient, logD

5.678

Water Solubility, LogSw

-6.23

Polar Surface Area

68.388

Acid Dissociation Constant (pKa)

21.90

Base Dissociation Constant (pKb)

6.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.00

C718-2659 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C718-2659 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C718-2659?
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What is the minimum amount of C718-2659 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C718-2659
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C718-2659
  • 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 C718-2659 available by request