3652-0126 Screening compound: 2-ethyl-1-(10H-phenothiazin-10-yl)butan-1-one

3652-0126 Screening compound: 2-ethyl-1-(10H-phenothiazin-10-yl)butan-1-one
3652-0126 Screening compound: 2-ethyl-1-(10H-phenothiazin-10-yl)butan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3652-0126
2-ethyl-1-(10H-phenothiazin-10-yl)butan-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

3652-0126

Molecular Formula

C18H19NOS (C18 H19 NOS)

Compound Name

2-ethyl-1-(10H-phenothiazin-10-yl)butan-1-one

IUPAC name

2-ethyl-1-(10H-phenothiazin-10-yl)butan-1-one

SMILES

CCC(CC)C(N1c(cccc2)c2Sc2c1cccc2)=O

InChI

InChI=1S/C18H19NOS/c1-3-13(4-2)18(20)19-14-9-5-7-11-16(14)21-17-12-8-6-10-15(17)19/h5-13H,3-4H2,1-2H3

InChI Key

ROEGEUDNRNSQJD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02127848

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

297.42

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

4.956

Distribution Coefficient, logD

4.956

Water Solubility, LogSw

-4.55

Polar Surface Area

14.141

Acid Dissociation Constant (pKa)

20.47

Base Dissociation Constant (pKb)

-3.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

3652-0126 in Drug Discovery

Included in Screening Libraries

ACE2 Library (3043 compounds)

Anti-Aging Library (44940 compounds)

CORONAVIRUS Library (20774 compounds)

DGK Inhibitors Library (10558 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 3652-0126 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3652-0126?
Check Price and Availability of 3652-0126, 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 3652-0126 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3652-0126
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3652-0126
  • 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 3652-0126 available by request