M338-0337 Screening compound: 3-(4-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)-N-[(pyridin-3-yl)methyl]-1,2,4-oxadiazole-5-carboxamide

M338-0337 Screening compound: 3-(4-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)-N-[(pyridin-3-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
M338-0337 Screening compound: 3-(4-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)-N-[(pyridin-3-yl)methyl]-1,2,4-oxadiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M338-0337
3-(4-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)-N-[(pyridin-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

M338-0337

Molecular Formula

C19H17N5O4 (C19 H17 N5 O4)

Compound Name

3-(4-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)-N-[(pyridin-3-yl)methyl]-1,2,4-oxadiazole-5-carboxamide

IUPAC name

3-(4-ethyl-3-oxo-34-dihydro-2H-14-benzoxazin-7-yl)-N-[(pyridin-3-yl)methyl]-124-oxadiazole-5-carboxamide

SMILES

CCN1c(ccc(-c2noc(C(NCc3cnccc3)=O)n2)c2)c2OCC1=O

InChI

InChI=1S/C19H17N5O4/c1-2-24-14-6-5-13(8-15(14)27-11-16(24)25)17-22-19(28-23-17)18(26)21-10-12-4-3-7-20-9-12/h3-9H,2,10-11H2,1H3,(H,21,26)

InChI Key

ZJHKIQMNGVAVKK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27537304

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

379.38

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.420

Distribution Coefficient, logD

1.420

Water Solubility, LogSw

-1.50

Polar Surface Area

89.673

Acid Dissociation Constant (pKa)

12.63

Base Dissociation Constant (pKb)

3.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

M338-0337 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics

References: we are preparing a list of scientific research reports with M338-0337 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M338-0337?
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What is the minimum amount of M338-0337 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M338-0337
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M338-0337
  • 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 M338-0337 available by request