L259-0762 Screening compound: 2-[2-(phenylsulfanyl)-1H-indol-3-yl]-1-[4-(2-pyrimidinyl)piperazino]-1-ethanone

L259-0762 Screening compound: 2-[2-(phenylsulfanyl)-1H-indol-3-yl]-1-[4-(2-pyrimidinyl)piperazino]-1-ethanone
L259-0762 Screening compound: 2-[2-(phenylsulfanyl)-1H-indol-3-yl]-1-[4-(2-pyrimidinyl)piperazino]-1-ethanone alternative view

Chemical Structure Depiction of ChemDiv screening compound L259-0762
2-[2-(phenylsulfanyl)-1H-indol-3-yl]-1-[4-(2-pyrimidinyl)piperazino]-1-ethanone

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

L259-0762

Molecular Formula

C24H23N5OS (C24 H23 N5 OS)

Compound Name

2-[2-(phenylsulfanyl)-1H-indol-3-yl]-1-[4-(2-pyrimidinyl)piperazino]-1-ethanone

IUPAC name

2-[2-(phenylsulfanyl)-1H-indol-3-yl]-1-[4-(pyrimidin-2-yl)piperazin-1-yl]ethan-1-one

SMILES

O=C(Cc(c(cccc1)c1[nH]1)c1Sc1ccccc1)N(CC1)CCN1c1ncccn1

InChI

InChI=1S/C24H23N5OS/c30-22(28-13-15-29(16-14-28)24-25-11-6-12-26-24)17-20-19-9-4-5-10-21(19)27-23(20)31-18-7-2-1-3-8-18/h1-12,27H,13-17H2

InChI Key

FSJZSHHDZNRWFI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15121190

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

429.55

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.269

Distribution Coefficient, logD

4.269

Water Solubility, LogSw

-4.33

Polar Surface Area

47.191

Acid Dissociation Constant (pKa)

16.33

Base Dissociation Constant (pKb)

2.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.83

L259-0762 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

Indole Derivatives (10091 compounds)

PI3K-Targeted Library (17255 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
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 L259-0762 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L259-0762?
Check Price and Availability of L259-0762, 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 L259-0762 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L259-0762
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L259-0762
  • 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 L259-0762 available by request