D216-0955 Screening compound: N-[(3-methoxyphenyl)methyl]-1-(pyrazin-2-yl)piperidine-3-carboxamide

D216-0955 Screening compound: N-[(3-methoxyphenyl)methyl]-1-(pyrazin-2-yl)piperidine-3-carboxamide
D216-0955 Screening compound: N-[(3-methoxyphenyl)methyl]-1-(pyrazin-2-yl)piperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D216-0955
N-[(3-methoxyphenyl)methyl]-1-(pyrazin-2-yl)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

D216-0955

Molecular Formula

C18H22N4O2 (C18 H22 N4 O2)

Compound Name

N-[(3-methoxyphenyl)methyl]-1-(pyrazin-2-yl)piperidine-3-carboxamide

IUPAC name

N-[(3-methoxyphenyl)methyl]-1-(pyrazin-2-yl)piperidine-3-carboxamide

SMILES

COc1cccc(CNC(C(CCC2)CN2c2nccnc2)=O)c1

InChI

InChI=1S/C18H22N4O2/c1-24-16-6-2-4-14(10-16)11-21-18(23)15-5-3-9-22(13-15)17-12-19-7-8-20-17/h2,4,6-8,10,12,15H,3,5,9,11,13H2,1H3,(H,21,23)

InChI Key

PQFQEJOMXRPARS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14814539

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

326.4

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.847

Distribution Coefficient, logD

1.847

Water Solubility, LogSw

-1.66

Polar Surface Area

53.611

Acid Dissociation Constant (pKa)

12.86

Base Dissociation Constant (pKb)

6.74

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.90

D216-0955 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D216-0955 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D216-0955?
Check Price and Availability of D216-0955, 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 D216-0955 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D216-0955
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D216-0955
  • 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 D216-0955 available by request