E540-0347 Screening compound: 2-[(3-chlorophenoxy)methyl]-8,9-dimethylfuro[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine

E540-0347 Screening compound: 2-[(3-chlorophenoxy)methyl]-8,9-dimethylfuro[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
E540-0347 Screening compound: 2-[(3-chlorophenoxy)methyl]-8,9-dimethylfuro[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound E540-0347
2-[(3-chlorophenoxy)methyl]-8,9-dimethylfuro[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine

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

E540-0347

Molecular Formula

C16H13ClN4O2 (C16 H13 ClN4 O2)

Compound Name

2-[(3-chlorophenoxy)methyl]-8,9-dimethylfuro[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine

IUPAC name

4-[(3-chlorophenoxy)methyl]-1112-dimethyl-10-oxa-3568-tetraazatricyclo[7.3.0.0^{26}]dodeca-1(9)24711-pentaene

SMILES

Cc1c(C)oc2c1c1nc(COc3cccc(Cl)c3)nn1cn2

InChI

InChI=1S/C16H13ClN4O2/c1-9-10(2)23-16-14(9)15-19-13(20-21(15)8-18-16)7-22-12-5-3-4-11(17)6-12/h3-6,8H,7H2,1-2H3

InChI Key

AWLIWXHVAXVMJJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14897215

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

328.76

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.449

Distribution Coefficient, logD

3.448

Water Solubility, LogSw

-3.59

Polar Surface Area

46.625

Acid Dissociation Constant (pKa)

28.16

Base Dissociation Constant (pKb)

4.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.75

E540-0347 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Purinergic Library (3321 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Nervous system
  • Cardiovascular
  • Metabolic
Agro:
  • Agro
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with E540-0347 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E540-0347?
Check Price and Availability of E540-0347, 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 E540-0347 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E540-0347
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E540-0347
  • 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 E540-0347 available by request