C736-0174 Screening compound: N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-2-phenyl-[1,2,4]triazolo[1,5-c]quinazolin-5-amine

C736-0174 Screening compound: N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-2-phenyl-[1,2,4]triazolo[1,5-c]quinazolin-5-amine
C736-0174 Screening compound: N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-2-phenyl-[1,2,4]triazolo[1,5-c]quinazolin-5-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound C736-0174
N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-2-phenyl-[1,2,4]triazolo[1,5-c]quinazolin-5-amine

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

C736-0174

Molecular Formula

C27H26FN7 (C27 H26 FN7)

Compound Name

N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-2-phenyl-[1,2,4]triazolo[1,5-c]quinazolin-5-amine

IUPAC name

N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-2-phenyl-[124]triazolo[15-c]quinazolin-5-amine

SMILES

Fc(cccc1)c1N1CCN(CCNc2nc(cccc3)c3c3nc(-c4ccccc4)nn23)CC1

InChI

InChI=1S/C27H26FN7/c28-22-11-5-7-13-24(22)34-18-16-33(17-19-34)15-14-29-27-30-23-12-6-4-10-21(23)26-31-25(32-35(26)27)20-8-2-1-3-9-20/h1-13H,14-19H2,(H,29,30)

InChI Key

VNDXJPBNEDFYDW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14789896

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

467.55

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.959

Distribution Coefficient, logD

4.478

Water Solubility, LogSw

-5.00

Polar Surface Area

48.412

Acid Dissociation Constant (pKa)

18.75

Base Dissociation Constant (pKb)

7.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

C736-0174 in Drug Discovery

Included in Screening Libraries

C-Met Library (15277 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
  • Nervous system
Targets:
  • Kinases
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C736-0174 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C736-0174?
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What is the minimum amount of C736-0174 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C736-0174
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C736-0174
  • 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 C736-0174 available by request