E744-0280 Screening compound: 2-{5-amino-4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}-N-(3-chloro-4-methylphenyl)acetamide

E744-0280 Screening compound: 2-{5-amino-4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}-N-(3-chloro-4-methylphenyl)acetamide
E744-0280 Screening compound: 2-{5-amino-4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}-N-(3-chloro-4-methylphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E744-0280
2-{5-amino-4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}-N-(3-chloro-4-methylphenyl)acetamide

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

E744-0280

Molecular Formula

C19H15ClFN7O2 (C19 H15 ClFN7 O2)

Compound Name

2-{5-amino-4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}-N-(3-chloro-4-methylphenyl)acetamide

IUPAC name

2-{5-amino-4-[3-(4-fluorophenyl)-124-oxadiazol-5-yl]-1H-123-triazol-1-yl}-N-(3-chloro-4-methylphenyl)acetamide

SMILES

Cc(ccc(NC(Cn1nnc(-c2nc(-c(cc3)ccc3F)no2)c1N)=O)c1)c1Cl

InChI

InChI=1S/C19H15ClFN7O2/c1-10-2-7-13(8-14(10)20)23-15(29)9-28-17(22)16(25-27-28)19-24-18(26-30-19)11-3-5-12(21)6-4-11/h2-8H,9,22H2,1H3,(H,23,29)

InChI Key

OLSSROJOXUDWRZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14914647

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.83

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.994

Distribution Coefficient, logD

3.994

Water Solubility, LogSw

-4.37

Polar Surface Area

100.751

Acid Dissociation Constant (pKa)

10.89

Base Dissociation Constant (pKb)

2.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

E744-0280 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with E744-0280 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E744-0280?
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What is the minimum amount of E744-0280 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E744-0280
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E744-0280
  • 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 E744-0280 available by request