M577-0894 Screening compound: 2-[1-(3-chlorophenyl)-1H-pyrrol-2-yl]-1-(4-methylpiperazin-1-yl)ethan-1-one

M577-0894 Screening compound: 2-[1-(3-chlorophenyl)-1H-pyrrol-2-yl]-1-(4-methylpiperazin-1-yl)ethan-1-one
M577-0894 Screening compound: 2-[1-(3-chlorophenyl)-1H-pyrrol-2-yl]-1-(4-methylpiperazin-1-yl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound M577-0894
2-[1-(3-chlorophenyl)-1H-pyrrol-2-yl]-1-(4-methylpiperazin-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

M577-0894

Molecular Formula

C17H20ClN3O (C17 H20 ClN3 O)

Compound Name

2-[1-(3-chlorophenyl)-1H-pyrrol-2-yl]-1-(4-methylpiperazin-1-yl)ethan-1-one

IUPAC name

2-[1-(3-chlorophenyl)-1H-pyrrol-2-yl]-1-(4-methylpiperazin-1-yl)ethan-1-one

SMILES

CN(CC1)CCN1C(Cc1cccn1-c1cccc(Cl)c1)=O

InChI

InChI=1S/C17H20ClN3O/c1-19-8-10-20(11-9-19)17(22)13-16-6-3-7-21(16)15-5-2-4-14(18)12-15/h2-7,12H,8-11,13H2,1H3

InChI Key

VLONXZRMYVSQNK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29019137

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

317.82

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.601

Distribution Coefficient, logD

2.375

Water Solubility, LogSw

-3.12

Polar Surface Area

22.365

Acid Dissociation Constant (pKa)

20.88

Base Dissociation Constant (pKb)

7.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.30

M577-0894 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

CNS BBB Library (22607 compounds)

SmartTM Library (51161 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Nervous system
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Nervous system
  • Cardiovascular
Mechanism of action:
  • Epigenetic
  • Epigenetic
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with M577-0894 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M577-0894?
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What is the minimum amount of M577-0894 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M577-0894
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M577-0894
  • 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 M577-0894 available by request