D679-1041 Screening compound: 4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]benzamide

D679-1041 Screening compound: 4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]benzamide
D679-1041 Screening compound: 4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D679-1041
4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]benzamide

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

D679-1041

Molecular Formula

C16H15N5O3 (C16 H15 N5 O3)

Compound Name

4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]benzamide

IUPAC name

4-(5-cyclopropyl-124-oxadiazol-3-yl)-N-[(5-methyl-124-oxadiazol-3-yl)methyl]benzamide

SMILES

Cc1nc(CNC(c(cc2)ccc2-c2noc(C3CC3)n2)=O)no1

InChI

InChI=1S/C16H15N5O3/c1-9-18-13(20-23-9)8-17-15(22)11-4-2-10(3-5-11)14-19-16(24-21-14)12-6-7-12/h2-5,12H,6-8H2,1H3,(H,17,22)

InChI Key

LMACIYOPEBOPGO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27596346

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

325.33

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.784

Distribution Coefficient, logD

2.784

Water Solubility, LogSw

-3.13

Polar Surface Area

88.748

Acid Dissociation Constant (pKa)

13.26

Base Dissociation Constant (pKb)

-2.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.30

D679-1041 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with D679-1041 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D679-1041?
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What is the minimum amount of D679-1041 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D679-1041
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D679-1041
  • 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 D679-1041 available by request