P166-2143 Screening compound: 1-{4-[(3-{6-[benzyl(ethyl)amino]pyridin-3-yl}-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl}ethan-1-one

P166-2143 Screening compound: 1-{4-[(3-{6-[benzyl(ethyl)amino]pyridin-3-yl}-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl}ethan-1-one
P166-2143 Screening compound: 1-{4-[(3-{6-[benzyl(ethyl)amino]pyridin-3-yl}-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl}ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound P166-2143
1-{4-[(3-{6-[benzyl(ethyl)amino]pyridin-3-yl}-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl}ethan-1-one

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

P166-2143

Molecular Formula

C23H28N6O2 (C23 H28 N6 O2)

Compound Name

1-{4-[(3-{6-[benzyl(ethyl)amino]pyridin-3-yl}-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl}ethan-1-one

IUPAC name

1-{4-[(3-{6-[benzyl(ethyl)amino]pyridin-3-yl}-124-oxadiazol-5-yl)methyl]piperazin-1-yl}ethan-1-one

SMILES

CCN(Cc1ccccc1)c(cc1)ncc1-c1noc(CN(CC2)CCN2C(C)=O)n1

InChI

InChI=1S/C23H28N6O2/c1-3-28(16-19-7-5-4-6-8-19)21-10-9-20(15-24-21)23-25-22(31-26-23)17-27-11-13-29(14-12-27)18(2)30/h4-10,15H,3,11-14,16-17H2,1-2H3

InChI Key

DRAYZCWZEFWJOQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27567500

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.51

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.979

Distribution Coefficient, logD

1.199

Water Solubility, LogSw

-2.79

Polar Surface Area

63.850

Acid Dissociation Constant (pKa)

23.33

Base Dissociation Constant (pKb)

9.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

P166-2143 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with P166-2143 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P166-2143?
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What is the minimum amount of P166-2143 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P166-2143
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P166-2143
  • 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 P166-2143 available by request