P166-1514 Screening compound: 3-[6-(4-methylpiperidino)-3-pyridyl]-5-(1,4-thiazinan-4-ylmethyl)-1,2,4-oxadiazole

P166-1514 Screening compound: 3-[6-(4-methylpiperidino)-3-pyridyl]-5-(1,4-thiazinan-4-ylmethyl)-1,2,4-oxadiazole
P166-1514 Screening compound: 3-[6-(4-methylpiperidino)-3-pyridyl]-5-(1,4-thiazinan-4-ylmethyl)-1,2,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound P166-1514
3-[6-(4-methylpiperidino)-3-pyridyl]-5-(1,4-thiazinan-4-ylmethyl)-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

P166-1514

Molecular Formula

C18H25N5OS (C18 H25 N5 OS)

Compound Name

3-[6-(4-methylpiperidino)-3-pyridyl]-5-(1,4-thiazinan-4-ylmethyl)-1,2,4-oxadiazole

IUPAC name

4-({3-[6-(4-methylpiperidin-1-yl)pyridin-3-yl]-124-oxadiazol-5-yl}methyl)thiomorpholine

SMILES

CC(CC1)CCN1c(cc1)ncc1-c1noc(CN2CCSCC2)n1

InChI

InChI=1S/C18H25N5OS/c1-14-4-6-23(7-5-14)16-3-2-15(12-19-16)18-20-17(24-21-18)13-22-8-10-25-11-9-22/h2-3,12,14H,4-11,13H2,1H3

InChI Key

LCZDNGJZYRXCCK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27567416

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

359.5

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.577

Distribution Coefficient, logD

2.334

Water Solubility, LogSw

-3.52

Polar Surface Area

47.367

Acid Dissociation Constant (pKa)

23.89

Base Dissociation Constant (pKb)

8.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

61.11

P166-1514 in Drug Discovery

Included in Screening Libraries

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

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with P166-1514 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P166-1514?
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What is the minimum amount of P166-1514 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P166-1514
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P166-1514
  • 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 P166-1514 available by request