M406-1385 Screening compound: 3-[4-(azepane-1-carbonyl)-2-oxopyrrolidin-1-yl]-N-(3-methylphenyl)benzamide

M406-1385 Screening compound: 3-[4-(azepane-1-carbonyl)-2-oxopyrrolidin-1-yl]-N-(3-methylphenyl)benzamide
M406-1385 Screening compound: 3-[4-(azepane-1-carbonyl)-2-oxopyrrolidin-1-yl]-N-(3-methylphenyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M406-1385
3-[4-(azepane-1-carbonyl)-2-oxopyrrolidin-1-yl]-N-(3-methylphenyl)benzamide

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

M406-1385

Molecular Formula

C25H29N3O3 (C25 H29 N3 O3)

Compound Name

3-[4-(azepane-1-carbonyl)-2-oxopyrrolidin-1-yl]-N-(3-methylphenyl)benzamide

IUPAC name

3-[4-(azepane-1-carbonyl)-2-oxopyrrolidin-1-yl]-N-(3-methylphenyl)benzamide

SMILES

Cc1cccc(NC(c2cccc(N(CC(C3)C(N4CCCCCC4)=O)C3=O)c2)=O)c1

InChI

InChI=1S/C25H29N3O3/c1-18-8-6-10-21(14-18)26-24(30)19-9-7-11-22(15-19)28-17-20(16-23(28)29)25(31)27-12-4-2-3-5-13-27/h6-11,14-15,20H,2-5,12-13,16-17H2,1H3,(H,26,30)/t20-/m1/s1

InChI Key

BNGFOHAEVZSOFE-HXUWFJFHSA-N

MDL Number (MFCD)

MFCD27540068

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.52

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.582

Distribution Coefficient, logD

3.582

Water Solubility, LogSw

-3.63

Polar Surface Area

57.059

Acid Dissociation Constant (pKa)

12.06

Base Dissociation Constant (pKb)

-0.53

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

M406-1385 in Drug Discovery

Included in Screening Libraries

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics

References: we are preparing a list of scientific research reports with M406-1385 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M406-1385?
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What is the minimum amount of M406-1385 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M406-1385
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M406-1385
  • 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 M406-1385 available by request