M626-0709 Screening compound: N-{[6-(azepan-1-yl)pyridin-3-yl]methyl}-2-bromobenzamide

M626-0709 Screening compound: N-{[6-(azepan-1-yl)pyridin-3-yl]methyl}-2-bromobenzamide
M626-0709 Screening compound: N-{[6-(azepan-1-yl)pyridin-3-yl]methyl}-2-bromobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M626-0709
N-{[6-(azepan-1-yl)pyridin-3-yl]methyl}-2-bromobenzamide

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

M626-0709

Molecular Formula

C19H22BrN3O (C19 H22 BrN3 O)

Compound Name

N-{[6-(azepan-1-yl)pyridin-3-yl]methyl}-2-bromobenzamide

IUPAC name

N-{[6-(azepan-1-yl)pyridin-3-yl]methyl}-2-bromobenzamide

SMILES

O=C(c(cccc1)c1Br)NCc(cc1)cnc1N1CCCCCC1

InChI

InChI=1S/C19H22BrN3O/c20-17-8-4-3-7-16(17)19(24)22-14-15-9-10-18(21-13-15)23-11-5-1-2-6-12-23/h3-4,7-10,13H,1-2,5-6,11-12,14H2,(H,22,24)

InChI Key

CITYSMIQJCBSNF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD13532983

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

388.31

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.336

Distribution Coefficient, logD

4.327

Water Solubility, LogSw

-4.14

Polar Surface Area

37.036

Acid Dissociation Constant (pKa)

12.42

Base Dissociation Constant (pKb)

5.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.80

M626-0709 in Drug Discovery

Included in Screening Libraries

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

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Ion Channels Focused Library (26372 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels
Agro:
  • Agro

References: we are preparing a list of scientific research reports with M626-0709 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M626-0709?
Check Price and Availability of M626-0709, 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 M626-0709 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M626-0709
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M626-0709
  • 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 M626-0709 available by request