M893-0111 Screening compound: N-(butan-2-yl)-2-(5-phenyl-1,3,4-oxadiazol-2-yl)acetamide

M893-0111 Screening compound: N-(butan-2-yl)-2-(5-phenyl-1,3,4-oxadiazol-2-yl)acetamide
M893-0111 Screening compound: N-(butan-2-yl)-2-(5-phenyl-1,3,4-oxadiazol-2-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M893-0111
N-(butan-2-yl)-2-(5-phenyl-1,3,4-oxadiazol-2-yl)acetamide

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

M893-0111

Molecular Formula

C14H17N3O2 (C14 H17 N3 O2)

Compound Name

N-(butan-2-yl)-2-(5-phenyl-1,3,4-oxadiazol-2-yl)acetamide

IUPAC name

N-[(2S)-butan-2-yl]-2-(5-phenyl-134-oxadiazol-2-yl)acetamide

SMILES

CCC(C)NC(Cc1nnc(-c2ccccc2)o1)=O

InChI

InChI=1S/C14H17N3O2/c1-3-10(2)15-12(18)9-13-16-17-14(19-13)11-7-5-4-6-8-11/h4-8,10H,3,9H2,1-2H3,(H,15,18)/t10-/m0/s1

InChI Key

LBTYFZAAWKQMDB-JTQLQIEISA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

259.31

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.774

Distribution Coefficient, logD

1.774

Water Solubility, LogSw

-2.17

Polar Surface Area

54.333

Acid Dissociation Constant (pKa)

16.10

Base Dissociation Constant (pKb)

1.43

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.70

M893-0111 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Glucocorticoid receptors Library (4806 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Endocrine
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with M893-0111 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M893-0111?
Check Price and Availability of M893-0111, 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 M893-0111 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M893-0111
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M893-0111
  • 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 M893-0111 available by request