L914-0581 Screening compound: 3-[(5-methyl-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)methyl]-N-[2-(morpholin-4-yl)ethyl]-1,2,4-oxadiazole-5-carboxamide

L914-0581 Screening compound: 3-[(5-methyl-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)methyl]-N-[2-(morpholin-4-yl)ethyl]-1,2,4-oxadiazole-5-carboxamide
L914-0581 Screening compound: 3-[(5-methyl-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)methyl]-N-[2-(morpholin-4-yl)ethyl]-1,2,4-oxadiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L914-0581
3-[(5-methyl-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)methyl]-N-[2-(morpholin-4-yl)ethyl]-1,2,4-oxadiazole-5-carboxamide

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

L914-0581

Molecular Formula

C18H21N5O5 (C18 H21 N5 O5)

Compound Name

3-[(5-methyl-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)methyl]-N-[2-(morpholin-4-yl)ethyl]-1,2,4-oxadiazole-5-carboxamide

IUPAC name

3-[(5-methyl-2-oxo-23-dihydro-13-benzoxazol-3-yl)methyl]-N-[2-(morpholin-4-yl)ethyl]-124-oxadiazole-5-carboxamide

SMILES

Cc(cc1)cc(N2Cc3noc(C(NCCN4CCOCC4)=O)n3)c1OC2=O

InChI

InChI=1S/C18H21N5O5/c1-12-2-3-14-13(10-12)23(18(25)27-14)11-15-20-17(28-21-15)16(24)19-4-5-22-6-8-26-9-7-22/h2-3,10H,4-9,11H2,1H3,(H,19,24)

InChI Key

BDWHHKQLDVGUHL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27486330

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

387.4

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

0.686

Distribution Coefficient, logD

0.625

Water Solubility, LogSw

-2.09

Polar Surface Area

92.152

Acid Dissociation Constant (pKa)

12.23

Base Dissociation Constant (pKb)

6.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.40

L914-0581 in Drug Discovery

Included in Screening Libraries

PI3K-Targeted Library (17255 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics

References: we are preparing a list of scientific research reports with L914-0581 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L914-0581?
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What is the minimum amount of L914-0581 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L914-0581
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L914-0581
  • 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 L914-0581 available by request