M617-1183 Screening compound: 2-benzyl-1-oxo-N~8~-(2-piperidinoethyl)-1,2,3,4-tetrahydropyrazino[1,2-a][1,3]benzimidazole-8-carboxamide

M617-1183 Screening compound: 2-benzyl-1-oxo-N~8~-(2-piperidinoethyl)-1,2,3,4-tetrahydropyrazino[1,2-a][1,3]benzimidazole-8-carboxamide
M617-1183 Screening compound: 2-benzyl-1-oxo-N~8~-(2-piperidinoethyl)-1,2,3,4-tetrahydropyrazino[1,2-a][1,3]benzimidazole-8-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M617-1183
2-benzyl-1-oxo-N~8~-(2-piperidinoethyl)-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

M617-1183

Molecular Formula

C25H29N5O2 (C25 H29 N5 O2)

Compound Name

2-benzyl-1-oxo-N~8~-(2-piperidinoethyl)-1,2,3,4-tetrahydropyrazino[1,2-a][1,3]benzimidazole-8-carboxamide

IUPAC name

11-benzyl-10-oxo-N-[2-(piperidin-1-yl)ethyl]-1811-triazatricyclo[7.4.0.0^{27}]trideca-2468-tetraene-5-carboxamide

SMILES

O=C(c(cc1)cc2c1n(CCN(Cc1ccccc1)C1=O)c1n2)NCCN1CCCCC1

InChI

InChI=1S/C25H29N5O2/c31-24(26-11-14-28-12-5-2-6-13-28)20-9-10-22-21(17-20)27-23-25(32)29(15-16-30(22)23)18-19-7-3-1-4-8-19/h1,3-4,7-10,17H,2,5-6,11-16,18H2,(H,26,31)

InChI Key

HMWZYVWHSCSNER-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27549127

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

431.54

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.602

Distribution Coefficient, logD

1.602

Water Solubility, LogSw

-3.10

Polar Surface Area

55.120

Acid Dissociation Constant (pKa)

12.54

Base Dissociation Constant (pKb)

8.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

M617-1183 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 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
Mechanism of action:
  • PPI modulators
  • PPI modulators

References: we are preparing a list of scientific research reports with M617-1183 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M617-1183?
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What is the minimum amount of M617-1183 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M617-1183
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M617-1183
  • 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 M617-1183 available by request