C695-0074 Screening compound: N-(5-chloro-2-methoxyphenyl)-2-{5-oxo-2-phenyl-5H,6H-[1,2,4]triazolo[1,5-c]quinazolin-6-yl}acetamide

C695-0074 Screening compound: N-(5-chloro-2-methoxyphenyl)-2-{5-oxo-2-phenyl-5H,6H-[1,2,4]triazolo[1,5-c]quinazolin-6-yl}acetamide
C695-0074 Screening compound: N-(5-chloro-2-methoxyphenyl)-2-{5-oxo-2-phenyl-5H,6H-[1,2,4]triazolo[1,5-c]quinazolin-6-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C695-0074
N-(5-chloro-2-methoxyphenyl)-2-{5-oxo-2-phenyl-5H,6H-[1,2,4]triazolo[1,5-c]quinazolin-6-yl}acetamide

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

C695-0074

Molecular Formula

C24H18ClN5O3 (C24 H18 ClN5 O3)

Compound Name

N-(5-chloro-2-methoxyphenyl)-2-{5-oxo-2-phenyl-5H,6H-[1,2,4]triazolo[1,5-c]quinazolin-6-yl}acetamide

IUPAC name

N-(5-chloro-2-methoxyphenyl)-2-{5-oxo-2-phenyl-5H6H-[124]triazolo[15-c]quinazolin-6-yl}acetamide

SMILES

COc(ccc(Cl)c1)c1NC(CN(c(cccc1)c1-c1nc(-c2ccccc2)nn11)C1=O)=O

InChI

InChI=1S/C24H18ClN5O3/c1-33-20-12-11-16(25)13-18(20)26-21(31)14-29-19-10-6-5-9-17(19)23-27-22(28-30(23)24(29)32)15-7-3-2-4-8-15/h2-13H,14H2,1H3,(H,26,31)

InChI Key

QVNOIFGFRMMKDF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14783421

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

459.89

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.410

Distribution Coefficient, logD

4.407

Water Solubility, LogSw

-4.62

Polar Surface Area

69.177

Acid Dissociation Constant (pKa)

9.55

Base Dissociation Constant (pKb)

1.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

C695-0074 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Purinergic Library (3321 compounds)

Targeted Diversity Library (40567 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Nervous system
  • Cardiovascular
  • Metabolic
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C695-0074 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C695-0074?
Check Price and Availability of C695-0074, 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 C695-0074 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C695-0074
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C695-0074
  • 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 C695-0074 available by request