M716-0204 Screening compound: 3-[6-(azepan-1-yl)pyridin-3-yl]-N-[2-(pyrrolidin-1-yl)ethyl]benzamide

M716-0204 Screening compound: 3-[6-(azepan-1-yl)pyridin-3-yl]-N-[2-(pyrrolidin-1-yl)ethyl]benzamide
M716-0204 Screening compound: 3-[6-(azepan-1-yl)pyridin-3-yl]-N-[2-(pyrrolidin-1-yl)ethyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M716-0204
3-[6-(azepan-1-yl)pyridin-3-yl]-N-[2-(pyrrolidin-1-yl)ethyl]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

M716-0204

Molecular Formula

C24H32N4O (C24 H32 N4 O)

Compound Name

3-[6-(azepan-1-yl)pyridin-3-yl]-N-[2-(pyrrolidin-1-yl)ethyl]benzamide

IUPAC name

3-[6-(azepan-1-yl)pyridin-3-yl]-N-[2-(pyrrolidin-1-yl)ethyl]benzamide

SMILES

O=C(c1cc(-c(cc2)cnc2N2CCCCCC2)ccc1)NCCN1CCCC1

InChI

InChI=1S/C24H32N4O/c29-24(25-12-17-27-13-5-6-14-27)21-9-7-8-20(18-21)22-10-11-23(26-19-22)28-15-3-1-2-4-16-28/h7-11,18-19H,1-6,12-17H2,(H,25,29)

InChI Key

MHLIWRBCNTYVFO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27552017

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.54

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.414

Distribution Coefficient, logD

3.006

Water Solubility, LogSw

-4.10

Polar Surface Area

40.955

Acid Dissociation Constant (pKa)

12.98

Base Dissociation Constant (pKb)

8.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

M716-0204 in Drug Discovery

Included in Screening Libraries

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

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

Cardiovascular Library (22201 compounds)

GPCR Targeted Library (31838 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cardiovascular
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands
  • PPI modulators

References: we are preparing a list of scientific research reports with M716-0204 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M716-0204?
Check Price and Availability of M716-0204, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of M716-0204 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M716-0204
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M716-0204
  • 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 M716-0204 available by request