C301-3396 Screening compound: N-[2-(3,4-diethoxyphenyl)ethyl]-5-(pyridin-3-yl)-1,3,4-oxadiazole-2-carboxamide

C301-3396 Screening compound: N-[2-(3,4-diethoxyphenyl)ethyl]-5-(pyridin-3-yl)-1,3,4-oxadiazole-2-carboxamide
C301-3396 Screening compound: N-[2-(3,4-diethoxyphenyl)ethyl]-5-(pyridin-3-yl)-1,3,4-oxadiazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-3396
N-[2-(3,4-diethoxyphenyl)ethyl]-5-(pyridin-3-yl)-1,3,4-oxadiazole-2-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

C301-3396

Molecular Formula

C20H22N4O4 (C20 H22 N4 O4)

Compound Name

N-[2-(3,4-diethoxyphenyl)ethyl]-5-(pyridin-3-yl)-1,3,4-oxadiazole-2-carboxamide

IUPAC name

N-[2-(34-diethoxyphenyl)ethyl]-5-(pyridin-3-yl)-134-oxadiazole-2-carboxamide

SMILES

CCOc(ccc(CCNC(c1nnc(-c2cnccc2)o1)=O)c1)c1OCC

InChI

InChI=1S/C20H22N4O4/c1-3-26-16-8-7-14(12-17(16)27-4-2)9-11-22-18(25)20-24-23-19(28-20)15-6-5-10-21-13-15/h5-8,10,12-13H,3-4,9,11H2,1-2H3,(H,22,25)

InChI Key

UXUIEJKUGVFLIE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14743100

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.42

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.024

Distribution Coefficient, logD

1.018

Water Solubility, LogSw

-1.43

Polar Surface Area

78.947

Acid Dissociation Constant (pKa)

13.21

Base Dissociation Constant (pKb)

5.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

C301-3396 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with C301-3396 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-3396?
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What is the minimum amount of C301-3396 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-3396
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-3396
  • 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 C301-3396 available by request