D679-0148 Screening compound: N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-3,4-dimethoxybenzamide

D679-0148 Screening compound: N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-3,4-dimethoxybenzamide
D679-0148 Screening compound: N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-3,4-dimethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D679-0148
N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-3,4-dimethoxybenzamide

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

D679-0148

Molecular Formula

C17H21N3O4 (C17 H21 N3 O4)

Compound Name

N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-3,4-dimethoxybenzamide

IUPAC name

N-[(5-cyclopentyl-124-oxadiazol-3-yl)methyl]-34-dimethoxybenzamide

SMILES

COc(ccc(C(NCc1noc(C2CCCC2)n1)=O)c1)c1OC

InChI

InChI=1S/C17H21N3O4/c1-22-13-8-7-12(9-14(13)23-2)16(21)18-10-15-19-17(24-20-15)11-5-3-4-6-11/h7-9,11H,3-6,10H2,1-2H3,(H,18,21)

InChI Key

CAZVSVMVIYLQDE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27596125

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

331.37

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.743

Distribution Coefficient, logD

2.743

Water Solubility, LogSw

-3.22

Polar Surface Area

73.139

Acid Dissociation Constant (pKa)

14.09

Base Dissociation Constant (pKb)

-2.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.10

D679-0148 in Drug Discovery

Included in Screening Libraries

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D679-0148 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D679-0148?
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What is the minimum amount of D679-0148 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D679-0148
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D679-0148
  • 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 D679-0148 available by request