3560-1977 Screening compound: N~1~-[3-(1H-1,3-benzimidazol-2-yl)propyl]-1-cyclohexanecarboxamide

3560-1977 Screening compound: N~1~-[3-(1H-1,3-benzimidazol-2-yl)propyl]-1-cyclohexanecarboxamide
3560-1977 Screening compound: N~1~-[3-(1H-1,3-benzimidazol-2-yl)propyl]-1-cyclohexanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3560-1977
N~1~-[3-(1H-1,3-benzimidazol-2-yl)propyl]-1-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

3560-1977

Molecular Formula

C17H23N3O (C17 H23 N3 O)

Compound Name

N~1~-[3-(1H-1,3-benzimidazol-2-yl)propyl]-1-cyclohexanecarboxamide

IUPAC name

N-[3-(1H-13-benzodiazol-2-yl)propyl]cyclohexanecarboxamide

SMILES

O=C(C1CCCCC1)NCCCc1nc(cccc2)c2[nH]1

InChI

InChI=1S/C17H23N3O/c21-17(13-7-2-1-3-8-13)18-12-6-11-16-19-14-9-4-5-10-15(14)20-16/h4-5,9-10,13H,1-3,6-8,11-12H2,(H,18,21)(H,19,20)

InChI Key

DDGQZBVHWQUICN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01988828

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

285.39

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.197

Distribution Coefficient, logD

3.189

Water Solubility, LogSw

-3.20

Polar Surface Area

44.967

Acid Dissociation Constant (pKa)

13.54

Base Dissociation Constant (pKb)

5.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.94

3560-1977 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 3560-1977 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3560-1977?
Check Price and Availability of 3560-1977, 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 3560-1977 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3560-1977
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3560-1977
  • 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 3560-1977 available by request