P166-1353 Screening compound: ethyl 1-({3-[6-(piperidin-1-yl)pyridin-3-yl]-1,2,4-oxadiazol-5-yl}methyl)piperidine-4-carboxylate

P166-1353 Screening compound: ethyl 1-({3-[6-(piperidin-1-yl)pyridin-3-yl]-1,2,4-oxadiazol-5-yl}methyl)piperidine-4-carboxylate
P166-1353 Screening compound: ethyl 1-({3-[6-(piperidin-1-yl)pyridin-3-yl]-1,2,4-oxadiazol-5-yl}methyl)piperidine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound P166-1353
ethyl 1-({3-[6-(piperidin-1-yl)pyridin-3-yl]-1,2,4-oxadiazol-5-yl}methyl)piperidine-4-carboxylate

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

P166-1353

Molecular Formula

C21H29N5O3 (C21 H29 N5 O3)

Compound Name

ethyl 1-({3-[6-(piperidin-1-yl)pyridin-3-yl]-1,2,4-oxadiazol-5-yl}methyl)piperidine-4-carboxylate

IUPAC name

ethyl 1-({3-[6-(piperidin-1-yl)pyridin-3-yl]-124-oxadiazol-5-yl}methyl)piperidine-4-carboxylate

SMILES

CCOC(C1CCN(Cc2nc(-c(cc3)cnc3N3CCCCC3)no2)CC1)=O

InChI

InChI=1S/C21H29N5O3/c1-2-28-21(27)16-8-12-25(13-9-16)15-19-23-20(24-29-19)17-6-7-18(22-14-17)26-10-4-3-5-11-26/h6-7,14,16H,2-5,8-13,15H2,1H3

InChI Key

YCKSDANJAQRTIQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27567363

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.49

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.601

Distribution Coefficient, logD

2.291

Water Solubility, LogSw

-3.25

Polar Surface Area

68.121

Acid Dissociation Constant (pKa)

23.55

Base Dissociation Constant (pKb)

8.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

61.90

P166-1353 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with P166-1353 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P166-1353?
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What is the minimum amount of P166-1353 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P166-1353
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P166-1353
  • 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 P166-1353 available by request