Z601-5361 Screening compound: 1-(1-benzyl-1H-imidazole-2-carbonyl)azepane

Z601-5361 Screening compound: 1-(1-benzyl-1H-imidazole-2-carbonyl)azepane
Z601-5361 Screening compound: 1-(1-benzyl-1H-imidazole-2-carbonyl)azepane alternative view

Chemical Structure Depiction of ChemDiv screening compound Z601-5361
1-(1-benzyl-1H-imidazole-2-carbonyl)azepane

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

Z601-5361

Molecular Formula

C17H21N3O (C17 H21 N3 O)

Compound Name

1-(1-benzyl-1H-imidazole-2-carbonyl)azepane

IUPAC name

1-(1-benzyl-1H-imidazole-2-carbonyl)azepane

SMILES

O=C(c1nccn1Cc1ccccc1)N1CCCCCC1

InChI

InChI=1S/C17H21N3O/c21-17(19-11-6-1-2-7-12-19)16-18-10-13-20(16)14-15-8-4-3-5-9-15/h3-5,8-10,13H,1-2,6-7,11-12,14H2

InChI Key

BHPXBTJFMRHMCN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27639572

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

283.37

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.646

Distribution Coefficient, logD

2.646

Water Solubility, LogSw

-2.66

Polar Surface Area

28.727

Acid Dissociation Constant (pKa)

22.14

Base Dissociation Constant (pKb)

1.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.20

Z601-5361 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Fragments Library (11262 compounds)

GPCR Targeted Library (31838 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with Z601-5361 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Z601-5361?
Check Price and Availability of Z601-5361, 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 Z601-5361 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Z601-5361
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Z601-5361
  • 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 Z601-5361 available by request