D134-0146 Screening compound: 4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-N-[(oxolan-2-yl)methyl]butanamide

D134-0146 Screening compound: 4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-N-[(oxolan-2-yl)methyl]butanamide
D134-0146 Screening compound: 4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-N-[(oxolan-2-yl)methyl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D134-0146
4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-N-[(oxolan-2-yl)methyl]butanamide

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

D134-0146

Molecular Formula

C18H23N3O3 (C18 H23 N3 O3)

Compound Name

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

IUPAC name

4-[3-(3-methylphenyl)-124-oxadiazol-5-yl]-N-[(oxolan-2-yl)methyl]butanamide

SMILES

Cc1cccc(-c2noc(CCCC(NCC3OCCC3)=O)n2)c1

InChI

InChI=1S/C18H23N3O3/c1-13-5-2-6-14(11-13)18-20-17(24-21-18)9-3-8-16(22)19-12-15-7-4-10-23-15/h2,5-6,11,15H,3-4,7-10,12H2,1H3,(H,19,22)/t15-/m1/s1

InChI Key

VNBALPSZWXYORU-OAHLLOKOSA-N

MDL Number (MFCD)

MFCD07188045

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

329.4

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.346

Distribution Coefficient, logD

2.346

Water Solubility, LogSw

-2.70

Polar Surface Area

64.436

Acid Dissociation Constant (pKa)

14.20

Base Dissociation Constant (pKb)

-0.33

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

D134-0146 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Dark Chemical Matter Library (18430 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 D134-0146 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D134-0146?
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What is the minimum amount of D134-0146 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D134-0146
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D134-0146
  • 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 D134-0146 available by request