D079-0160 Screening compound: 2-methyl-1-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]piperidine

D079-0160 Screening compound: 2-methyl-1-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]piperidine
D079-0160 Screening compound: 2-methyl-1-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound D079-0160
2-methyl-1-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]piperidine

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

D079-0160

Molecular Formula

C15H19N3O (C15 H19 N3 O)

Compound Name

2-methyl-1-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]piperidine

IUPAC name

2-methyl-1-[(5-phenyl-134-oxadiazol-2-yl)methyl]piperidine

SMILES

CC1N(Cc2nnc(-c3ccccc3)o2)CCCC1

InChI

InChI=1S/C15H19N3O/c1-12-7-5-6-10-18(12)11-14-16-17-15(19-14)13-8-3-2-4-9-13/h2-4,8-9,12H,5-7,10-11H2,1H3/t12-/m0/s1

InChI Key

TVLRBVCAHBHTEH-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD07423478

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

257.34

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.381

Distribution Coefficient, logD

2.358

Water Solubility, LogSw

-2.41

Polar Surface Area

33.603

Acid Dissociation Constant (pKa)

27.96

Base Dissociation Constant (pKb)

6.12

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

46.70

D079-0160 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS MPO Library (28609 compounds)

Fragments Library (11262 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

SmartTM Library (51161 compounds)

Soluble Diversity Library (15920 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Nervous system
Structure:
  • Fragments
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with D079-0160 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D079-0160?
Check Price and Availability of D079-0160, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of D079-0160 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D079-0160
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D079-0160
  • 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 D079-0160 available by request