G796-2027 Screening compound: 1-(1H-1,3-benzodiazol-2-yl)-N-[(2-methoxyphenyl)methyl]piperidine-3-carboxamide

G796-2027 Screening compound: 1-(1H-1,3-benzodiazol-2-yl)-N-[(2-methoxyphenyl)methyl]piperidine-3-carboxamide
G796-2027 Screening compound: 1-(1H-1,3-benzodiazol-2-yl)-N-[(2-methoxyphenyl)methyl]piperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G796-2027
1-(1H-1,3-benzodiazol-2-yl)-N-[(2-methoxyphenyl)methyl]piperidine-3-carboxamide

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

G796-2027

Molecular Formula

C21H24N4O2 (C21 H24 N4 O2)

Compound Name

1-(1H-1,3-benzodiazol-2-yl)-N-[(2-methoxyphenyl)methyl]piperidine-3-carboxamide

IUPAC name

1-(1H-13-benzodiazol-2-yl)-N-[(2-methoxyphenyl)methyl]piperidine-3-carboxamide

SMILES

COc1c(CNC(C(CCC2)CN2c2nc(cccc3)c3[nH]2)=O)cccc1

InChI

InChI=1S/C21H24N4O2/c1-27-19-11-5-2-7-15(19)13-22-20(26)16-8-6-12-25(14-16)21-23-17-9-3-4-10-18(17)24-21/h2-5,7,9-11,16H,6,8,12-14H2,1H3,(H,22,26)(H,23,24)/t16-/m0/s1

InChI Key

KYIGLKBCWBVFND-INIZCTEOSA-N

MDL Number (MFCD)

MFCD15036787

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

364.45

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.831

Distribution Coefficient, logD

2.783

Water Solubility, LogSw

-3.14

Polar Surface Area

53.886

Acid Dissociation Constant (pKa)

12.49

Base Dissociation Constant (pKb)

6.47

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

G796-2027 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 compounds)

Protein-Protein Interaction Library (218420 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Immune system
Mechanism of action:
  • PPI modulators
  • Receptor's ligands
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with G796-2027 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G796-2027?
Check Price and Availability of G796-2027, 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 G796-2027 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G796-2027
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G796-2027
  • 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 G796-2027 available by request