G702-4296 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(2-furyl)-6,7-dihydro-5H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin-8-yl]amine

G702-4296 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(2-furyl)-6,7-dihydro-5H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin-8-yl]amine
G702-4296 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(2-furyl)-6,7-dihydro-5H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin-8-yl]amine alternative view

Chemical Structure Depiction of ChemDiv screening compound G702-4296
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(2-furyl)-6,7-dihydro-5H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin-8-yl]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

G702-4296

Molecular Formula

C20H17N5O3 (C20 H17 N5 O3)

Compound Name

N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(2-furyl)-6,7-dihydro-5H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin-8-yl]amine

IUPAC name

N-(23-dihydro-14-benzodioxin-6-yl)-11-(furan-2-yl)-181012-tetraazatricyclo[7.3.0.0^{37}]dodeca-27911-tetraen-2-amine

SMILES

C1Cc2nc3nc(-c4ccco4)nn3c(Nc(cc3)cc4c3OCCO4)c2C1

InChI

InChI=1S/C20H17N5O3/c1-3-13-14(4-1)22-20-23-18(16-5-2-8-26-16)24-25(20)19(13)21-12-6-7-15-17(11-12)28-10-9-27-15/h2,5-8,11,21H,1,3-4,9-10H2

InChI Key

MDDRCASUNDQDAX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27152040

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

375.39

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.482

Distribution Coefficient, logD

2.482

Water Solubility, LogSw

-2.85

Polar Surface Area

66.660

Acid Dissociation Constant (pKa)

11.96

Base Dissociation Constant (pKb)

1.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

G702-4296 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anti-Inflammatory Library (24602 compounds)

Antimitotic Tubulin Library (17355 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

C-Met Library (15277 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
Targets:
  • Kinases
Mechanism of action:
  • Receptor's ligands
Agro:
  • Agro

References: we are preparing a list of scientific research reports with G702-4296 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G702-4296?
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What is the minimum amount of G702-4296 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G702-4296
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G702-4296
  • 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 G702-4296 available by request