C301-2726 Screening compound: 5-[(2-chloro-4-fluorophenyl)methyl]-N-(2-methoxyethyl)-1,3,4-oxadiazole-2-carboxamide

C301-2726 Screening compound: 5-[(2-chloro-4-fluorophenyl)methyl]-N-(2-methoxyethyl)-1,3,4-oxadiazole-2-carboxamide
C301-2726 Screening compound: 5-[(2-chloro-4-fluorophenyl)methyl]-N-(2-methoxyethyl)-1,3,4-oxadiazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-2726
5-[(2-chloro-4-fluorophenyl)methyl]-N-(2-methoxyethyl)-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

C301-2726

Molecular Formula

C13H13ClFN3O3 (C13 H13 ClFN3 O3)

Compound Name

5-[(2-chloro-4-fluorophenyl)methyl]-N-(2-methoxyethyl)-1,3,4-oxadiazole-2-carboxamide

IUPAC name

5-[(2-chloro-4-fluorophenyl)methyl]-N-(2-methoxyethyl)-134-oxadiazole-2-carboxamide

SMILES

COCCNC(c1nnc(Cc(ccc(F)c2)c2Cl)o1)=O

InChI

InChI=1S/C13H13ClFN3O3/c1-20-5-4-16-12(19)13-18-17-11(21-13)6-8-2-3-9(15)7-10(8)14/h2-3,7H,4-6H2,1H3,(H,16,19)

InChI Key

ZIHZUDKTLQUVQA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14742750

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

313.72

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.856

Distribution Coefficient, logD

1.856

Water Solubility, LogSw

-2.76

Polar Surface Area

63.289

Acid Dissociation Constant (pKa)

13.15

Base Dissociation Constant (pKb)

-2.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.80

C301-2726 in Drug Discovery

Included in Screening Libraries

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with C301-2726 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-2726?
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What is the minimum amount of C301-2726 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-2726
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-2726
  • 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 C301-2726 available by request