M626-0701 Screening compound: N-{[6-(azepan-1-yl)pyridin-3-yl]methyl}cyclohexanecarboxamide

M626-0701 Screening compound: N-{[6-(azepan-1-yl)pyridin-3-yl]methyl}cyclohexanecarboxamide
M626-0701 Screening compound: N-{[6-(azepan-1-yl)pyridin-3-yl]methyl}cyclohexanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M626-0701
N-{[6-(azepan-1-yl)pyridin-3-yl]methyl}cyclohexanecarboxamide

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

M626-0701

Molecular Formula

C19H29N3O (C19 H29 N3 O)

Compound Name

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

IUPAC name

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

SMILES

O=C(C1CCCCC1)NCc(cc1)cnc1N1CCCCCC1

InChI

InChI=1S/C19H29N3O/c23-19(17-8-4-3-5-9-17)21-15-16-10-11-18(20-14-16)22-12-6-1-2-7-13-22/h10-11,14,17H,1-9,12-13,15H2,(H,21,23)

InChI Key

ZVRNSBGRMLSASJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD18125019

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

315.46

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

3.855

Distribution Coefficient, logD

3.846

Water Solubility, LogSw

-3.75

Polar Surface Area

37.228

Acid Dissociation Constant (pKa)

14.23

Base Dissociation Constant (pKb)

5.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

68.40

M626-0701 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)

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with M626-0701 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M626-0701?
Check Price and Availability of M626-0701, 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 M626-0701 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M626-0701
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M626-0701
  • 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 M626-0701 available by request