D560-0061 Screening compound: 1-(2-phenoxyethyl)-6,7-dihydro-1H-[1,4]dioxino[2,3-f][1,3]benzimidazole

D560-0061 Screening compound: 1-(2-phenoxyethyl)-6,7-dihydro-1H-[1,4]dioxino[2,3-f][1,3]benzimidazole
D560-0061 Screening compound: 1-(2-phenoxyethyl)-6,7-dihydro-1H-[1,4]dioxino[2,3-f][1,3]benzimidazole alternative view

Chemical Structure Depiction of ChemDiv screening compound D560-0061
1-(2-phenoxyethyl)-6,7-dihydro-1H-[1,4]dioxino[2,3-f][1,3]benzimidazole

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

D560-0061

Molecular Formula

C17H16N2O3 (C17 H16 N2 O3)

Compound Name

1-(2-phenoxyethyl)-6,7-dihydro-1H-[1,4]dioxino[2,3-f][1,3]benzimidazole

IUPAC name

6-(2-phenoxyethyl)-1013-dioxa-46-diazatricyclo[7.4.0.0^{37}]trideca-1(9)247-tetraene

SMILES

C(COc1ccccc1)n(cnc1c2)c1cc1c2OCCO1

InChI

InChI=1S/C17H16N2O3/c1-2-4-13(5-3-1)20-7-6-19-12-18-14-10-16-17(11-15(14)19)22-9-8-21-16/h1-5,10-12H,6-9H2

InChI Key

WWAAHNBADBLPIE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27592149

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

296.33

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.841

Distribution Coefficient, logD

1.817

Water Solubility, LogSw

-1.87

Polar Surface Area

33.642

Acid Dissociation Constant (pKa)

24.02

Base Dissociation Constant (pKb)

6.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

D560-0061 in Drug Discovery

Included in Screening Libraries

Antibacterial Compounds Library (13827 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D560-0061 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D560-0061?
Check Price and Availability of D560-0061, 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 D560-0061 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D560-0061
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D560-0061
  • 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 D560-0061 available by request