5594-0940 Screening compound: 1-(10H-phenothiazin-10-yl)-2-(piperidin-1-yl)ethan-1-one

5594-0940 Screening compound: 1-(10H-phenothiazin-10-yl)-2-(piperidin-1-yl)ethan-1-one
5594-0940 Screening compound: 1-(10H-phenothiazin-10-yl)-2-(piperidin-1-yl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 5594-0940
1-(10H-phenothiazin-10-yl)-2-(piperidin-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

5594-0940

Molecular Formula

C19H20N2OS (C19 H20 N2 OS)

Compound Name

1-(10H-phenothiazin-10-yl)-2-(piperidin-1-yl)ethan-1-one

IUPAC name

1-(10H-phenothiazin-10-yl)-2-(piperidin-1-yl)ethan-1-one

SMILES

O=C(CN1CCCCC1)N1c(cccc2)c2Sc2c1cccc2

InChI

InChI=1S/C19H20N2OS/c22-19(14-20-12-6-1-7-13-20)21-15-8-2-4-10-17(15)23-18-11-5-3-9-16(18)21/h2-5,8-11H,1,6-7,12-14H2

InChI Key

SAOXTUXETQWGLY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00496510

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

324.45

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.531

Distribution Coefficient, logD

3.530

Water Solubility, LogSw

-3.71

Polar Surface Area

17.346

Acid Dissociation Constant (pKa)

21.91

Base Dissociation Constant (pKb)

4.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

5594-0940 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

CNS BBB Library (22607 compounds)

DGK Inhibitors Library (10558 compounds)

Nucleic Acid Ligands (8311 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Nervous system
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system
Mechanism of action:
  • Epigenetic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 5594-0940 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5594-0940?
Check Price and Availability of 5594-0940, 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 5594-0940 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5594-0940
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5594-0940
  • 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 5594-0940 available by request