E018-2292 Screening compound: 3-[(4-chlorophenyl)sulfanyl]-6-methoxy-2-[4-(pyridin-2-yl)piperazine-1-carbonyl]-1H-indole

E018-2292 Screening compound: 3-[(4-chlorophenyl)sulfanyl]-6-methoxy-2-[4-(pyridin-2-yl)piperazine-1-carbonyl]-1H-indole
E018-2292 Screening compound: 3-[(4-chlorophenyl)sulfanyl]-6-methoxy-2-[4-(pyridin-2-yl)piperazine-1-carbonyl]-1H-indole alternative view

Chemical Structure Depiction of ChemDiv screening compound E018-2292
3-[(4-chlorophenyl)sulfanyl]-6-methoxy-2-[4-(pyridin-2-yl)piperazine-1-carbonyl]-1H-indole

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

E018-2292

Molecular Formula

C25H23ClN4O2S (C25 H23 ClN4 O2 S)

Compound Name

3-[(4-chlorophenyl)sulfanyl]-6-methoxy-2-[4-(pyridin-2-yl)piperazine-1-carbonyl]-1H-indole

IUPAC name

3-[(4-chlorophenyl)sulfanyl]-6-methoxy-2-[4-(pyridin-2-yl)piperazine-1-carbonyl]-1H-indole

SMILES

COc(cc1)cc2c1c(Sc(cc1)ccc1Cl)c(C(N(CC1)CCN1c1ncccc1)=O)[nH]2

InChI

InChI=1S/C25H23ClN4O2S/c1-32-18-7-10-20-21(16-18)28-23(24(20)33-19-8-5-17(26)6-9-19)25(31)30-14-12-29(13-15-30)22-4-2-3-11-27-22/h2-11,16,28H,12-15H2,1H3

InChI Key

HTRQCCNXKFLYFV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14839454

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

479

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

5.484

Distribution Coefficient, logD

5.475

Water Solubility, LogSw

-6.03

Polar Surface Area

46.050

Acid Dissociation Constant (pKa)

15.24

Base Dissociation Constant (pKb)

5.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

E018-2292 in Drug Discovery

Included in Screening Libraries

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

SmartTM Library (51161 compounds)

Anti-HIV1 Library (19540 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with E018-2292 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E018-2292?
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What is the minimum amount of E018-2292 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E018-2292
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E018-2292
  • 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 E018-2292 available by request