P166-1948 Screening compound: 4-(5-{5-[(4-butylpiperazin-1-yl)methyl]-1,2,4-oxadiazol-3-yl}pyridin-2-yl)morpholine

P166-1948 Screening compound: 4-(5-{5-[(4-butylpiperazin-1-yl)methyl]-1,2,4-oxadiazol-3-yl}pyridin-2-yl)morpholine
P166-1948 Screening compound: 4-(5-{5-[(4-butylpiperazin-1-yl)methyl]-1,2,4-oxadiazol-3-yl}pyridin-2-yl)morpholine alternative view

Chemical Structure Depiction of ChemDiv screening compound P166-1948
4-(5-{5-[(4-butylpiperazin-1-yl)methyl]-1,2,4-oxadiazol-3-yl}pyridin-2-yl)morpholine

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

P166-1948

Molecular Formula

C20H30N6O2 (C20 H30 N6 O2)

Compound Name

4-(5-{5-[(4-butylpiperazin-1-yl)methyl]-1,2,4-oxadiazol-3-yl}pyridin-2-yl)morpholine

IUPAC name

4-(5-{5-[(4-butylpiperazin-1-yl)methyl]-124-oxadiazol-3-yl}pyridin-2-yl)morpholine

SMILES

CCCCN1CCN(Cc2nc(-c(cc3)cnc3N3CCOCC3)no2)CC1

InChI

InChI=1S/C20H30N6O2/c1-2-3-6-24-7-9-25(10-8-24)16-19-22-20(23-28-19)17-4-5-18(21-15-17)26-11-13-27-14-12-26/h4-5,15H,2-3,6-14,16H2,1H3

InChI Key

FFCMQCZYCLRPPX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD22596063

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.5

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.606

Distribution Coefficient, logD

1.303

Water Solubility, LogSw

-2.55

Polar Surface Area

59.066

Acid Dissociation Constant (pKa)

24.57

Base Dissociation Constant (pKb)

8.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

65.00

P166-1948 in Drug Discovery

Included in Screening Libraries

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

PI3K-Targeted Library (17255 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with P166-1948 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P166-1948?
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What is the minimum amount of P166-1948 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P166-1948
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P166-1948
  • 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 P166-1948 available by request