D069-0172 Screening compound: 3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-[(oxolan-2-yl)methyl]propanamide

D069-0172 Screening compound: 3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-[(oxolan-2-yl)methyl]propanamide
D069-0172 Screening compound: 3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-[(oxolan-2-yl)methyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D069-0172
3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-[(oxolan-2-yl)methyl]propanamide

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

D069-0172

Molecular Formula

C17H21N3O4 (C17 H21 N3 O4)

Compound Name

3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-[(oxolan-2-yl)methyl]propanamide

IUPAC name

3-[3-(4-methoxyphenyl)-124-oxadiazol-5-yl]-N-[(oxolan-2-yl)methyl]propanamide

SMILES

COc(cc1)ccc1-c1noc(CCC(NCC2OCCC2)=O)n1

InChI

InChI=1S/C17H21N3O4/c1-22-13-6-4-12(5-7-13)17-19-16(24-20-17)9-8-15(21)18-11-14-3-2-10-23-14/h4-7,14H,2-3,8-11H2,1H3,(H,18,21)/t14-/m1/s1

InChI Key

CUHSXMHQYOFNPB-CQSZACIVSA-N

MDL Number (MFCD)

MFCD05696835

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

331.37

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.841

Distribution Coefficient, logD

1.841

Water Solubility, LogSw

-2.20

Polar Surface Area

71.979

Acid Dissociation Constant (pKa)

14.19

Base Dissociation Constant (pKb)

-0.06

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

47.10

D069-0172 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Annotated Library (21441 compounds)

Dark Chemical Matter Library (18430 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool

References: we are preparing a list of scientific research reports with D069-0172 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D069-0172?
Check Price and Availability of D069-0172, 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 D069-0172 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D069-0172
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D069-0172
  • 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 D069-0172 available by request