D078-0039 Screening compound: N-{2-[1-(2-phenoxyethyl)-1H-1,3-benzodiazol-2-yl]ethyl}furan-2-carboxamide

D078-0039 Screening compound: N-{2-[1-(2-phenoxyethyl)-1H-1,3-benzodiazol-2-yl]ethyl}furan-2-carboxamide
D078-0039 Screening compound: N-{2-[1-(2-phenoxyethyl)-1H-1,3-benzodiazol-2-yl]ethyl}furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D078-0039
N-{2-[1-(2-phenoxyethyl)-1H-1,3-benzodiazol-2-yl]ethyl}furan-2-carboxamide

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

D078-0039

Molecular Formula

C22H21N3O3 (C22 H21 N3 O3)

Compound Name

N-{2-[1-(2-phenoxyethyl)-1H-1,3-benzodiazol-2-yl]ethyl}furan-2-carboxamide

IUPAC name

N-{2-[1-(2-phenoxyethyl)-1H-13-benzodiazol-2-yl]ethyl}furan-2-carboxamide

SMILES

O=C(c1ccco1)NCCc1nc(cccc2)c2n1CCOc1ccccc1

InChI

InChI=1S/C22H21N3O3/c26-22(20-11-6-15-28-20)23-13-12-21-24-18-9-4-5-10-19(18)25(21)14-16-27-17-7-2-1-3-8-17/h1-11,15H,12-14,16H2,(H,23,26)

InChI Key

BXAACALGYBKTSO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07189096

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

375.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.569

Distribution Coefficient, logD

3.569

Water Solubility, LogSw

-3.51

Polar Surface Area

51.373

Acid Dissociation Constant (pKa)

13.65

Base Dissociation Constant (pKb)

2.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

References: we are preparing a list of scientific research reports with D078-0039 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D078-0039?
Check Price and Availability of D078-0039, 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 D078-0039 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D078-0039
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D078-0039
  • 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 D078-0039 available by request