D678-0601 Screening compound: N-{[5-(4-methoxyphenyl)-1,2,4-oxadiazol-3-yl]methyl}-2,2-dimethylpropanamide

D678-0601 Screening compound: N-{[5-(4-methoxyphenyl)-1,2,4-oxadiazol-3-yl]methyl}-2,2-dimethylpropanamide
D678-0601 Screening compound: N-{[5-(4-methoxyphenyl)-1,2,4-oxadiazol-3-yl]methyl}-2,2-dimethylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D678-0601
N-{[5-(4-methoxyphenyl)-1,2,4-oxadiazol-3-yl]methyl}-2,2-dimethylpropanamide

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

D678-0601

Molecular Formula

C15H19N3O3 (C15 H19 N3 O3)

Compound Name

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

IUPAC name

N-{[5-(4-methoxyphenyl)-124-oxadiazol-3-yl]methyl}-22-dimethylpropanamide

SMILES

CC(C)(C)C(NCc1noc(-c(cc2)ccc2OC)n1)=O

InChI

InChI=1S/C15H19N3O3/c1-15(2,3)14(19)16-9-12-17-13(21-18-12)10-5-7-11(20-4)8-6-10/h5-8H,9H2,1-4H3,(H,16,19)

InChI Key

BGLQWUURVFNAOL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27596021

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

289.33

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.669

Distribution Coefficient, logD

2.669

Water Solubility, LogSw

-2.96

Polar Surface Area

65.135

Acid Dissociation Constant (pKa)

13.57

Base Dissociation Constant (pKb)

-5.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

D678-0601 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with D678-0601 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D678-0601?
Check Price and Availability of D678-0601, 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 D678-0601 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D678-0601
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D678-0601
  • 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 D678-0601 available by request