E018-2447 Screening compound: 3-[(4-chlorophenyl)sulfanyl]-6-methoxy-N-[3-(piperidin-1-yl)propyl]-1H-indole-2-carboxamide

E018-2447 Screening compound: 3-[(4-chlorophenyl)sulfanyl]-6-methoxy-N-[3-(piperidin-1-yl)propyl]-1H-indole-2-carboxamide
E018-2447 Screening compound: 3-[(4-chlorophenyl)sulfanyl]-6-methoxy-N-[3-(piperidin-1-yl)propyl]-1H-indole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E018-2447
3-[(4-chlorophenyl)sulfanyl]-6-methoxy-N-[3-(piperidin-1-yl)propyl]-1H-indole-2-carboxamide

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

E018-2447

Molecular Formula

C24H28ClN3O2S (C24 H28 ClN3 O2 S)

Compound Name

3-[(4-chlorophenyl)sulfanyl]-6-methoxy-N-[3-(piperidin-1-yl)propyl]-1H-indole-2-carboxamide

IUPAC name

3-[(4-chlorophenyl)sulfanyl]-6-methoxy-N-[3-(piperidin-1-yl)propyl]-1H-indole-2-carboxamide

SMILES

COc(cc1)cc2c1c(Sc(cc1)ccc1Cl)c(C(NCCCN1CCCCC1)=O)[nH]2

InChI

InChI=1S/C24H28ClN3O2S/c1-30-18-8-11-20-21(16-18)27-22(23(20)31-19-9-6-17(25)7-10-19)24(29)26-12-5-15-28-13-3-2-4-14-28/h6-11,16,27H,2-5,12-15H2,1H3,(H,26,29)

InChI Key

VBQNMKPKCRAQNG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14839479

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

458.02

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.007

Distribution Coefficient, logD

2.411

Water Solubility, LogSw

-5.05

Polar Surface Area

45.868

Acid Dissociation Constant (pKa)

15.88

Base Dissociation Constant (pKb)

10.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

E018-2447 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-infective Library (19449 compounds)

Anticancer Library (62698 compounds)

CNS targets activity set (6557 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with E018-2447 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E018-2447?
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What is the minimum amount of E018-2447 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E018-2447
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E018-2447
  • 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 E018-2447 available by request