Y020-4401 Screening compound: 4-(2-methoxyphenyl)-2-piperidinopyrimidine

Y020-4401 Screening compound: 4-(2-methoxyphenyl)-2-piperidinopyrimidine
Y020-4401 Screening compound: 4-(2-methoxyphenyl)-2-piperidinopyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-4401
4-(2-methoxyphenyl)-2-piperidinopyrimidine

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

Y020-4401

Molecular Formula

C16H19N3O (C16 H19 N3 O)

Compound Name

4-(2-methoxyphenyl)-2-piperidinopyrimidine

IUPAC name

4-(2-methoxyphenyl)-2-(piperidin-1-yl)pyrimidine

SMILES

COc(cccc1)c1-c1nc(N2CCCCC2)ncc1

InChI

InChI=1S/C16H19N3O/c1-20-15-8-4-3-7-13(15)14-9-10-17-16(18-14)19-11-5-2-6-12-19/h3-4,7-10H,2,5-6,11-12H2,1H3

InChI Key

WPJPKRMHHIBUGP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00483174

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

269.35

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.556

Distribution Coefficient, logD

3.556

Water Solubility, LogSw

-3.69

Polar Surface Area

28.980

Acid Dissociation Constant (pKa)

20.48

Base Dissociation Constant (pKb)

7.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

Y020-4401 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Agro:
  • Agro
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with Y020-4401 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-4401?
Check Price and Availability of Y020-4401, 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 Y020-4401 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-4401
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-4401
  • 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 Y020-4401 available by request