C736-0602 Screening compound: N-[2-(4-chlorophenyl)ethyl]-8,9-dimethoxy-2-(pyridin-3-yl)-[1,2,4]triazolo[1,5-c]quinazolin-5-amine

C736-0602 Screening compound: N-[2-(4-chlorophenyl)ethyl]-8,9-dimethoxy-2-(pyridin-3-yl)-[1,2,4]triazolo[1,5-c]quinazolin-5-amine
C736-0602 Screening compound: N-[2-(4-chlorophenyl)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 C736-0602
N-[2-(4-chlorophenyl)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

C736-0602

Molecular Formula

C24H21ClN6O2 (C24 H21 ClN6 O2)

Compound Name

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

IUPAC name

N-[2-(4-chlorophenyl)ethyl]-89-dimethoxy-2-(pyridin-3-yl)-[124]triazolo[15-c]quinazolin-5-amine

SMILES

COc(c(OC)c1)cc2c1nc(NCCc(cc1)ccc1Cl)n1nc(-c3cnccc3)nc12

InChI

InChI=1S/C24H21ClN6O2/c1-32-20-12-18-19(13-21(20)33-2)28-24(27-11-9-15-5-7-17(25)8-6-15)31-23(18)29-22(30-31)16-4-3-10-26-14-16/h3-8,10,12-14H,9,11H2,1-2H3,(H,27,28)

InChI Key

OVVICBBXCHRIJG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14790098

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

460.92

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.819

Distribution Coefficient, logD

1.689

Water Solubility, LogSw

-4.51

Polar Surface Area

66.249

Acid Dissociation Constant (pKa)

19.64

Base Dissociation Constant (pKb)

9.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

C736-0602 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Anticancer Library (62698 compounds)

C-Met Library (15277 compounds)

CNS Targets (44014 compounds)

KRAS-Targeted Library (16000 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with C736-0602 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C736-0602?
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What is the minimum amount of C736-0602 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C736-0602
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C736-0602
  • 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 C736-0602 available by request