E939-0227 Screening compound: 1-[3-(4-chlorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-yl]-4-(3-methoxyphenyl)piperazine

E939-0227 Screening compound: 1-[3-(4-chlorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-yl]-4-(3-methoxyphenyl)piperazine
E939-0227 Screening compound: 1-[3-(4-chlorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-yl]-4-(3-methoxyphenyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound E939-0227
1-[3-(4-chlorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-yl]-4-(3-methoxyphenyl)piperazine

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

E939-0227

Molecular Formula

C22H20ClN5O2 (C22 H20 ClN5 O2)

Compound Name

1-[3-(4-chlorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-yl]-4-(3-methoxyphenyl)piperazine

IUPAC name

1-[3-(4-chlorophenyl)-[12]oxazolo[54-d]pyrimidin-4-yl]-4-(3-methoxyphenyl)piperazine

SMILES

COc1cccc(N(CC2)CCN2c2c(c(-c(cc3)ccc3Cl)no3)c3ncn2)c1

InChI

InChI=1S/C22H20ClN5O2/c1-29-18-4-2-3-17(13-18)27-9-11-28(12-10-27)21-19-20(15-5-7-16(23)8-6-15)26-30-22(19)25-14-24-21/h2-8,13-14H,9-12H2,1H3

InChI Key

ARZZMRZMQOSDLH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14928769

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

421.89

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.945

Distribution Coefficient, logD

4.945

Water Solubility, LogSw

-5.30

Polar Surface Area

56.339

Acid Dissociation Constant (pKa)

21.21

Base Dissociation Constant (pKb)

6.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

E939-0227 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with E939-0227 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E939-0227?
Check Price and Availability of E939-0227, 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 E939-0227 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E939-0227
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E939-0227
  • 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 E939-0227 available by request