E899-0152 Screening compound: 4-[3-(4-fluorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-yl]-2-methyl-1-(3-methylphenyl)piperazine

E899-0152 Screening compound: 4-[3-(4-fluorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-yl]-2-methyl-1-(3-methylphenyl)piperazine
E899-0152 Screening compound: 4-[3-(4-fluorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-yl]-2-methyl-1-(3-methylphenyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound E899-0152
4-[3-(4-fluorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-yl]-2-methyl-1-(3-methylphenyl)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

E899-0152

Molecular Formula

C23H22FN5O (C23 H22 FN5 O)

Compound Name

4-[3-(4-fluorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-yl]-2-methyl-1-(3-methylphenyl)piperazine

IUPAC name

4-[3-(4-fluorophenyl)-[12]oxazolo[54-d]pyrimidin-4-yl]-2-methyl-1-(3-methylphenyl)piperazine

SMILES

CC(CN(CC1)c2c(c(-c(cc3)ccc3F)no3)c3ncn2)N1c1cc(C)ccc1

InChI

InChI=1S/C23H22FN5O/c1-15-4-3-5-19(12-15)29-11-10-28(13-16(29)2)22-20-21(17-6-8-18(24)9-7-17)27-30-23(20)26-14-25-22/h3-9,12,14,16H,10-11,13H2,1-2H3/t16-/m0/s1

InChI Key

DHAJCRUETCGMHE-INIZCTEOSA-N

MDL Number (MFCD)

MFCD14926699

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

403.46

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.906

Distribution Coefficient, logD

4.906

Water Solubility, LogSw

-4.88

Polar Surface Area

48.013

Acid Dissociation Constant (pKa)

21.18

Base Dissociation Constant (pKb)

7.63

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.10

E899-0152 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with E899-0152 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E899-0152?
Check Price and Availability of E899-0152, 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 E899-0152 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E899-0152
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E899-0152
  • 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 E899-0152 available by request