S259-0923 Screening compound: 1-{4-[(5-METHYL-4-ISOXAZOLYL)METHYL]PIPERAZINO}-3-(1,3,5-TRIMETHYL-1H-PYRAZOL-4-YL)-1-PROPANONE

S259-0923 Screening compound: 1-{4-[(5-METHYL-4-ISOXAZOLYL)METHYL]PIPERAZINO}-3-(1,3,5-TRIMETHYL-1H-PYRAZOL-4-YL)-1-PROPANONE
S259-0923 Screening compound: 1-{4-[(5-METHYL-4-ISOXAZOLYL)METHYL]PIPERAZINO}-3-(1,3,5-TRIMETHYL-1H-PYRAZOL-4-YL)-1-PROPANONE alternative view

Chemical Structure Depiction of ChemDiv screening compound S259-0923
1-{4-[(5-METHYL-4-ISOXAZOLYL)METHYL]PIPERAZINO}-3-(1,3,5-TRIMETHYL-1H-PYRAZOL-4-YL)-1-PROPANONE

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

S259-0923

Molecular Formula

C18H27N5O2 (C18 H27 N5 O2)

Compound Name

1-{4-[(5-METHYL-4-ISOXAZOLYL)METHYL]PIPERAZINO}-3-(1,3,5-TRIMETHYL-1H-PYRAZOL-4-YL)-1-PROPANONE

IUPAC name

n/a

SMILES

Cc1c(CCC(N2CCN(Cc3c(C)onc3)CC2)=O)c(C)nn1C

InChI

InChI=1S/C18H27N5O2/c1-13-17(14(2)21(4)20-13)5-6-18(24)23-9-7-22(8-10-23)12-16-11-19-25-15(16)3/h11H,5-10,12H2,1-4H3

InChI Key

BALQIFNRJVJDDL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD28042077

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

345.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

-0.130

Distribution Coefficient, logD

-0.895

Water Solubility, LogSw

0.11

Polar Surface Area

56.624

Acid Dissociation Constant (pKa)

22.19

Base Dissociation Constant (pKb)

8.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

61.10

S259-0923 in Drug Discovery

Included in Screening Libraries

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with S259-0923 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S259-0923?
Check Price and Availability of S259-0923, 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 S259-0923 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S259-0923
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S259-0923
  • 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 S259-0923 available by request