G944-0206 Screening compound: 1-ethyl-5-{5-[(4-fluorophenyl)methyl]-1,2,4-oxadiazol-3-yl}-1H-1,2,3-benzotriazole

G944-0206 Screening compound: 1-ethyl-5-{5-[(4-fluorophenyl)methyl]-1,2,4-oxadiazol-3-yl}-1H-1,2,3-benzotriazole
G944-0206 Screening compound: 1-ethyl-5-{5-[(4-fluorophenyl)methyl]-1,2,4-oxadiazol-3-yl}-1H-1,2,3-benzotriazole alternative view

Chemical Structure Depiction of ChemDiv screening compound G944-0206
1-ethyl-5-{5-[(4-fluorophenyl)methyl]-1,2,4-oxadiazol-3-yl}-1H-1,2,3-benzotriazole

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

G944-0206

Molecular Formula

C17H14FN5O (C17 H14 FN5 O)

Compound Name

1-ethyl-5-{5-[(4-fluorophenyl)methyl]-1,2,4-oxadiazol-3-yl}-1H-1,2,3-benzotriazole

IUPAC name

1-ethyl-5-{5-[(4-fluorophenyl)methyl]-124-oxadiazol-3-yl}-1H-123-benzotriazole

SMILES

CCn1nnc2c1ccc(-c1noc(Cc(cc3)ccc3F)n1)c2

InChI

InChI=1S/C17H14FN5O/c1-2-23-15-8-5-12(10-14(15)20-22-23)17-19-16(24-21-17)9-11-3-6-13(18)7-4-11/h3-8,10H,2,9H2,1H3

InChI Key

FTWHHXVJGBHCLC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27169190

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

323.33

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.564

Distribution Coefficient, logD

3.564

Water Solubility, LogSw

-3.66

Polar Surface Area

56.732

Acid Dissociation Constant (pKa)

26.27

Base Dissociation Constant (pKb)

0.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

G944-0206 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 G944-0206 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G944-0206?
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What is the minimum amount of G944-0206 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G944-0206
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G944-0206
  • 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 G944-0206 available by request