L914-1127 Screening compound: 3-[(5-chloro-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)methyl]-N-({1-[(2-fluorophenyl)methyl]piperidin-4-yl}methyl)-1,2,4-oxadiazole-5-carboxamide

L914-1127 Screening compound: 3-[(5-chloro-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)methyl]-N-({1-[(2-fluorophenyl)methyl]piperidin-4-yl}methyl)-1,2,4-oxadiazole-5-carboxamide
L914-1127 Screening compound: 3-[(5-chloro-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)methyl]-N-({1-[(2-fluorophenyl)methyl]piperidin-4-yl}methyl)-1,2,4-oxadiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L914-1127
3-[(5-chloro-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)methyl]-N-({1-[(2-fluorophenyl)methyl]piperidin-4-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

L914-1127

Molecular Formula

C24H23ClFN5O4 (C24 H23 ClFN5 O4)

Compound Name

3-[(5-chloro-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)methyl]-N-({1-[(2-fluorophenyl)methyl]piperidin-4-yl}methyl)-1,2,4-oxadiazole-5-carboxamide

IUPAC name

3-[(5-chloro-2-oxo-23-dihydro-13-benzoxazol-3-yl)methyl]-N-({1-[(2-fluorophenyl)methyl]piperidin-4-yl}methyl)-124-oxadiazole-5-carboxamide

SMILES

O=C(c1nc(CN(c(cc(cc2)Cl)c2O2)C2=O)no1)NCC1CCN(Cc(cccc2)c2F)CC1

InChI

InChI=1S/C24H23ClFN5O4/c25-17-5-6-20-19(11-17)31(24(33)34-20)14-21-28-23(35-29-21)22(32)27-12-15-7-9-30(10-8-15)13-16-3-1-2-4-18(16)26/h1-6,11,15H,7-10,12-14H2,(H,27,32)

InChI Key

LBUWBYQIPFOOFZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27486406

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

499.93

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.656

Distribution Coefficient, logD

1.866

Water Solubility, LogSw

-4.32

Polar Surface Area

84.152

Acid Dissociation Constant (pKa)

13.03

Base Dissociation Constant (pKb)

9.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

L914-1127 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 L914-1127 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L914-1127?
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What is the minimum amount of L914-1127 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L914-1127
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L914-1127
  • 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 L914-1127 available by request