8019-4405 Screening compound: 2-[(4,5-dimethyl-1H-imidazol-2-yl)sulfanyl]-1-(10H-phenothiazin-10-yl)ethan-1-one

8019-4405 Screening compound: 2-[(4,5-dimethyl-1H-imidazol-2-yl)sulfanyl]-1-(10H-phenothiazin-10-yl)ethan-1-one
8019-4405 Screening compound: 2-[(4,5-dimethyl-1H-imidazol-2-yl)sulfanyl]-1-(10H-phenothiazin-10-yl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-4405
2-[(4,5-dimethyl-1H-imidazol-2-yl)sulfanyl]-1-(10H-phenothiazin-10-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

8019-4405

Molecular Formula

C19H17N3OS2 (C19 H17 N3 OS2)

Compound Name

2-[(4,5-dimethyl-1H-imidazol-2-yl)sulfanyl]-1-(10H-phenothiazin-10-yl)ethan-1-one

IUPAC name

2-[(45-dimethyl-1H-imidazol-2-yl)sulfanyl]-1-(10H-phenothiazin-10-yl)ethan-1-one

SMILES

Cc([nH]1)c(C)nc1SCC(N1c(cccc2)c2Sc2c1cccc2)=O

InChI

InChI=1S/C19H17N3OS2/c1-12-13(2)21-19(20-12)24-11-18(23)22-14-7-3-5-9-16(14)25-17-10-6-4-8-15(17)22/h3-10H,11H2,1-2H3,(H,20,21)

InChI Key

ZNIZDJPPYIRQDP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10037844

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

367.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.799

Distribution Coefficient, logD

3.793

Water Solubility, LogSw

-4.01

Polar Surface Area

32.808

Acid Dissociation Constant (pKa)

9.56

Base Dissociation Constant (pKb)

5.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

8019-4405 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 8019-4405 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-4405?
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What is the minimum amount of 8019-4405 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-4405
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-4405
  • 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 8019-4405 available by request