D677-0592 Screening compound: N-{[5-(furan-2-yl)-1,2,4-oxadiazol-3-yl]methyl}-2-methylpropanamide

D677-0592 Screening compound: N-{[5-(furan-2-yl)-1,2,4-oxadiazol-3-yl]methyl}-2-methylpropanamide
D677-0592 Screening compound: N-{[5-(furan-2-yl)-1,2,4-oxadiazol-3-yl]methyl}-2-methylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D677-0592
N-{[5-(furan-2-yl)-1,2,4-oxadiazol-3-yl]methyl}-2-methylpropanamide

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

D677-0592

Molecular Formula

C11H13N3O3 (C11 H13 N3 O3)

Compound Name

N-{[5-(furan-2-yl)-1,2,4-oxadiazol-3-yl]methyl}-2-methylpropanamide

IUPAC name

N-{[5-(furan-2-yl)-124-oxadiazol-3-yl]methyl}-2-methylpropanamide

SMILES

CC(C)C(NCc1noc(-c2ccco2)n1)=O

InChI

InChI=1S/C11H13N3O3/c1-7(2)10(15)12-6-9-13-11(17-14-9)8-4-3-5-16-8/h3-5,7H,6H2,1-2H3,(H,12,15)

InChI Key

RBNORUMTWVJKBA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27595854

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

235.24

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.172

Distribution Coefficient, logD

1.172

Water Solubility, LogSw

-1.71

Polar Surface Area

66.170

Acid Dissociation Constant (pKa)

14.13

Base Dissociation Constant (pKb)

-4.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

D677-0592 in Drug Discovery

Included in Screening Libraries

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

CNS MPO Library (28609 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with D677-0592 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D677-0592?
Check Price and Availability of D677-0592, 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 D677-0592 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D677-0592
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D677-0592
  • 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 D677-0592 available by request