M535-1316 Screening compound: 2-(azepan-1-yl)-4-cyclopropaneamido-N-cyclopropylbenzamide

M535-1316 Screening compound: 2-(azepan-1-yl)-4-cyclopropaneamido-N-cyclopropylbenzamide
M535-1316 Screening compound: 2-(azepan-1-yl)-4-cyclopropaneamido-N-cyclopropylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M535-1316
2-(azepan-1-yl)-4-cyclopropaneamido-N-cyclopropylbenzamide

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

M535-1316

Molecular Formula

C20H27N3O2 (C20 H27 N3 O2)

Compound Name

2-(azepan-1-yl)-4-cyclopropaneamido-N-cyclopropylbenzamide

IUPAC name

2-(azepan-1-yl)-4-cyclopropaneamido-N-cyclopropylbenzamide

SMILES

O=C(C1CC1)Nc(cc1)cc(N2CCCCCC2)c1C(NC1CC1)=O

InChI

InChI=1S/C20H27N3O2/c24-19(14-5-6-14)22-16-9-10-17(20(25)21-15-7-8-15)18(13-16)23-11-3-1-2-4-12-23/h9-10,13-15H,1-8,11-12H2,(H,21,25)(H,22,24)

InChI Key

FYAVVRDFNULITE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27546678

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

341.45

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.808

Distribution Coefficient, logD

3.807

Water Solubility, LogSw

-3.99

Polar Surface Area

51.805

Acid Dissociation Constant (pKa)

10.04

Base Dissociation Constant (pKb)

3.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

60.00

M535-1316 in Drug Discovery

Included in Screening Libraries

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

Ion Channels Focused Library (26372 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels
Agro:
  • Agro

References: we are preparing a list of scientific research reports with M535-1316 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M535-1316?
Check Price and Availability of M535-1316, 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 M535-1316 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M535-1316
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M535-1316
  • 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 M535-1316 available by request