G221-0585 Screening compound: 3-chloro-N-[(2-fluorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-2-methylaniline

G221-0585 Screening compound: 3-chloro-N-[(2-fluorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-2-methylaniline
G221-0585 Screening compound: 3-chloro-N-[(2-fluorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-2-methylaniline alternative view

Chemical Structure Depiction of ChemDiv screening compound G221-0585
3-chloro-N-[(2-fluorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-2-methylaniline

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

G221-0585

Molecular Formula

C22H17ClFN3O (C22 H17 ClFN3 O)

Compound Name

3-chloro-N-[(2-fluorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-2-methylaniline

IUPAC name

3-chloro-N-[(2-fluorophenyl)(5-phenyl-134-oxadiazol-2-yl)methyl]-2-methylaniline

SMILES

Cc(c(NC(c1nnc(-c2ccccc2)o1)c(cccc1)c1F)ccc1)c1Cl

InChI

InChI=1S/C22H17ClFN3O/c1-14-17(23)11-7-13-19(14)25-20(16-10-5-6-12-18(16)24)22-27-26-21(28-22)15-8-3-2-4-9-15/h2-13,20,25H,1H3/t20-/m1/s1

InChI Key

UZDSQXFZLRBELV-HXUWFJFHSA-N

MDL Number (MFCD)

MFCD14988562

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.85

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.021

Distribution Coefficient, logD

6.021

Water Solubility, LogSw

-6.22

Polar Surface Area

39.371

Acid Dissociation Constant (pKa)

15.80

Base Dissociation Constant (pKb)

-3.45

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

9.10

G221-0585 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cardiovascular
Agro:
  • Agro

References: we are preparing a list of scientific research reports with G221-0585 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G221-0585?
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What is the minimum amount of G221-0585 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G221-0585
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G221-0585
  • 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 G221-0585 available by request