T619-3352 Screening compound: 5-(1-{[3-(4-FLUOROBENZYL)-1,2,4-OXADIAZOL-5-YL]METHYL}-2-PIPERIDYL)-3-METHYL-1,2,4-OXADIAZOLE

T619-3352 Screening compound: 5-(1-{[3-(4-FLUOROBENZYL)-1,2,4-OXADIAZOL-5-YL]METHYL}-2-PIPERIDYL)-3-METHYL-1,2,4-OXADIAZOLE
T619-3352 Screening compound: 5-(1-{[3-(4-FLUOROBENZYL)-1,2,4-OXADIAZOL-5-YL]METHYL}-2-PIPERIDYL)-3-METHYL-1,2,4-OXADIAZOLE alternative view

Chemical Structure Depiction of ChemDiv screening compound T619-3352
5-(1-{[3-(4-FLUOROBENZYL)-1,2,4-OXADIAZOL-5-YL]METHYL}-2-PIPERIDYL)-3-METHYL-1,2,4-OXADIAZOLE

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

T619-3352

Molecular Formula

C18H20FN5O2 (C18 H20 FN5 O2)

Compound Name

5-(1-{[3-(4-FLUOROBENZYL)-1,2,4-OXADIAZOL-5-YL]METHYL}-2-PIPERIDYL)-3-METHYL-1,2,4-OXADIAZOLE

IUPAC name

n/a

SMILES

Cc1noc(C2N(Cc3nc(Cc(cc4)ccc4F)no3)CCCC2)n1

InChI

InChI=1S/C18H20FN5O2/c1-12-20-18(26-22-12)15-4-2-3-9-24(15)11-17-21-16(23-25-17)10-13-5-7-14(19)8-6-13/h5-8,15H,2-4,9-11H2,1H3/t15-/m0/s1

InChI Key

PQGZTHABRSVOCL-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD29027871

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

357.39

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.861

Distribution Coefficient, logD

2.860

Water Solubility, LogSw

-2.91

Polar Surface Area

67.454

Acid Dissociation Constant (pKa)

27.43

Base Dissociation Constant (pKb)

4.85

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

44.40

T619-3352 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

SmartTM Library (51161 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with T619-3352 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T619-3352?
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What is the minimum amount of T619-3352 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T619-3352
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T619-3352
  • 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 T619-3352 available by request