C718-1477 Screening compound: 1-[7-chloro-3-(3,4-dimethylbenzenesulfonyl)-[1,2,3]triazolo[1,5-a]quinazolin-5-yl]-4-methylpiperazine

C718-1477 Screening compound: 1-[7-chloro-3-(3,4-dimethylbenzenesulfonyl)-[1,2,3]triazolo[1,5-a]quinazolin-5-yl]-4-methylpiperazine
C718-1477 Screening compound: 1-[7-chloro-3-(3,4-dimethylbenzenesulfonyl)-[1,2,3]triazolo[1,5-a]quinazolin-5-yl]-4-methylpiperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound C718-1477
1-[7-chloro-3-(3,4-dimethylbenzenesulfonyl)-[1,2,3]triazolo[1,5-a]quinazolin-5-yl]-4-methylpiperazine

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

C718-1477

Molecular Formula

C22H23ClN6O2S (C22 H23 ClN6 O2 S)

Compound Name

1-[7-chloro-3-(3,4-dimethylbenzenesulfonyl)-[1,2,3]triazolo[1,5-a]quinazolin-5-yl]-4-methylpiperazine

IUPAC name

1-[7-chloro-3-(34-dimethylbenzenesulfonyl)-[123]triazolo[15-a]quinazolin-5-yl]-4-methylpiperazine

SMILES

Cc(cc1)c(C)cc1S(c(nnn1c(cc2)c3cc2Cl)c1nc3N1CCN(C)CC1)(=O)=O

InChI

InChI=1S/C22H23ClN6O2S/c1-14-4-6-17(12-15(14)2)32(30,31)22-21-24-20(28-10-8-27(3)9-11-28)18-13-16(23)5-7-19(18)29(21)26-25-22/h4-7,12-13H,8-11H2,1-3H3

InChI Key

LGKXHTZADSEUCY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07656173

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

470.98

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.715

Distribution Coefficient, logD

4.250

Water Solubility, LogSw

-4.72

Polar Surface Area

68.605

Acid Dissociation Constant (pKa)

21.41

Base Dissociation Constant (pKb)

7.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

C718-1477 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 C718-1477 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C718-1477?
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What is the minimum amount of C718-1477 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C718-1477
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C718-1477
  • 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 C718-1477 available by request