L914-0458 Screening compound: N-[(4-methoxyphenyl)methyl]-3-[(5-methyl-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)methyl]-1,2,4-oxadiazole-5-carboxamide

L914-0458 Screening compound: N-[(4-methoxyphenyl)methyl]-3-[(5-methyl-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
L914-0458 Screening compound: N-[(4-methoxyphenyl)methyl]-3-[(5-methyl-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)methyl]-1,2,4-oxadiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L914-0458
N-[(4-methoxyphenyl)methyl]-3-[(5-methyl-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)methyl]-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

L914-0458

Molecular Formula

C20H18N4O5 (C20 H18 N4 O5)

Compound Name

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

IUPAC name

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

SMILES

Cc(cc1)cc(N2Cc3noc(C(NCc(cc4)ccc4OC)=O)n3)c1OC2=O

InChI

InChI=1S/C20H18N4O5/c1-12-3-8-16-15(9-12)24(20(26)28-16)11-17-22-19(29-23-17)18(25)21-10-13-4-6-14(27-2)7-5-13/h3-9H,10-11H2,1-2H3,(H,21,25)

InChI Key

NVZNLVPVXDNVLC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27486304

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

394.39

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.596

Distribution Coefficient, logD

2.596

Water Solubility, LogSw

-3.04

Polar Surface Area

87.964

Acid Dissociation Constant (pKa)

12.44

Base Dissociation Constant (pKb)

-3.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

L914-0458 in Drug Discovery

Included in Screening Libraries

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics

References: we are preparing a list of scientific research reports with L914-0458 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L914-0458?
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What is the minimum amount of L914-0458 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L914-0458
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L914-0458
  • 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 L914-0458 available by request