M617-1295 Screening compound: 2-cyclohexyl-N~8~-[2-(2-methylpiperidino)ethyl]-1-oxo-1,2,3,4-tetrahydropyrazino[1,2-a][1,3]benzimidazole-8-carboxamide

M617-1295 Screening compound: 2-cyclohexyl-N~8~-[2-(2-methylpiperidino)ethyl]-1-oxo-1,2,3,4-tetrahydropyrazino[1,2-a][1,3]benzimidazole-8-carboxamide
M617-1295 Screening compound: 2-cyclohexyl-N~8~-[2-(2-methylpiperidino)ethyl]-1-oxo-1,2,3,4-tetrahydropyrazino[1,2-a][1,3]benzimidazole-8-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M617-1295
2-cyclohexyl-N~8~-[2-(2-methylpiperidino)ethyl]-1-oxo-1,2,3,4-tetrahydropyrazino[1,2-a][1,3]benzimidazole-8-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

M617-1295

Molecular Formula

C25H35N5O2 (C25 H35 N5 O2)

Compound Name

2-cyclohexyl-N~8~-[2-(2-methylpiperidino)ethyl]-1-oxo-1,2,3,4-tetrahydropyrazino[1,2-a][1,3]benzimidazole-8-carboxamide

IUPAC name

n/a

SMILES

CC1N(CCNC(c(cc2)cc3c2n(CCN(C2CCCCC2)C2=O)c2n3)=O)CCCC1

InChI

InChI=1S/C25H35N5O2/c1-18-7-5-6-13-28(18)14-12-26-24(31)19-10-11-22-21(17-19)27-23-25(32)29(15-16-30(22)23)20-8-3-2-4-9-20/h10-11,17-18,20H,2-9,12-16H2,1H3,(H,26,31)/t18-/m0/s1

InChI Key

XTXYZAHOUPMUAA-SFHVURJKSA-N

MDL Number (MFCD)

MFCD27549187

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

437.59

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.139

Distribution Coefficient, logD

1.907

Water Solubility, LogSw

-3.22

Polar Surface Area

53.958

Acid Dissociation Constant (pKa)

12.54

Base Dissociation Constant (pKb)

8.61

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

64.00

M617-1295 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

DGK Inhibitors Library (10558 compounds)

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein-Protein Interaction Library (218420 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Mimetics
Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
  • PPI modulators

References: we are preparing a list of scientific research reports with M617-1295 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M617-1295?
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What is the minimum amount of M617-1295 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M617-1295
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M617-1295
  • 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 M617-1295 available by request