C736-0634 Screening compound: N-[2-(2,5-dimethoxyphenyl)ethyl]-8,9-dimethoxy-2-(pyridin-3-yl)-[1,2,4]triazolo[1,5-c]quinazolin-5-amine

C736-0634 Screening compound: N-[2-(2,5-dimethoxyphenyl)ethyl]-8,9-dimethoxy-2-(pyridin-3-yl)-[1,2,4]triazolo[1,5-c]quinazolin-5-amine
C736-0634 Screening compound: N-[2-(2,5-dimethoxyphenyl)ethyl]-8,9-dimethoxy-2-(pyridin-3-yl)-[1,2,4]triazolo[1,5-c]quinazolin-5-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound C736-0634
N-[2-(2,5-dimethoxyphenyl)ethyl]-8,9-dimethoxy-2-(pyridin-3-yl)-[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

C736-0634

Molecular Formula

C26H26N6O4 (C26 H26 N6 O4)

Compound Name

N-[2-(2,5-dimethoxyphenyl)ethyl]-8,9-dimethoxy-2-(pyridin-3-yl)-[1,2,4]triazolo[1,5-c]quinazolin-5-amine

IUPAC name

N-[2-(25-dimethoxyphenyl)ethyl]-89-dimethoxy-2-(pyridin-3-yl)-[124]triazolo[15-c]quinazolin-5-amine

SMILES

COc(cc1)cc(CCNc(n2nc(-c3cnccc3)nc2c2c3)nc2cc(OC)c3OC)c1OC

InChI

InChI=1S/C26H26N6O4/c1-33-18-7-8-21(34-2)16(12-18)9-11-28-26-29-20-14-23(36-4)22(35-3)13-19(20)25-30-24(31-32(25)26)17-6-5-10-27-15-17/h5-8,10,12-15H,9,11H2,1-4H3,(H,28,29)

InChI Key

ZLUJQWKKFUJWJD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14790105

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

486.53

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.574

Distribution Coefficient, logD

1.443

Water Solubility, LogSw

-3.60

Polar Surface Area

81.423

Acid Dissociation Constant (pKa)

19.64

Base Dissociation Constant (pKb)

9.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

C736-0634 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anticancer Library (62698 compounds)

Antiviral Annotated Library (21441 compounds)

C-Met Library (15277 compounds)

KRAS-Targeted Library (16000 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases
  • Kinases
Mechanism of action:
  • Receptor's ligands
Agro:
  • Agro

References: we are preparing a list of scientific research reports with C736-0634 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C736-0634?
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What is the minimum amount of C736-0634 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C736-0634
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C736-0634
  • 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 C736-0634 available by request