E944-0470 Screening compound: 2-{benzyl[3-(4-fluorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-yl]amino}ethan-1-ol

E944-0470 Screening compound: 2-{benzyl[3-(4-fluorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-yl]amino}ethan-1-ol
E944-0470 Screening compound: 2-{benzyl[3-(4-fluorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-yl]amino}ethan-1-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound E944-0470
2-{benzyl[3-(4-fluorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-yl]amino}ethan-1-ol

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

E944-0470

Molecular Formula

C20H17FN4O2 (C20 H17 FN4 O2)

Compound Name

2-{benzyl[3-(4-fluorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-yl]amino}ethan-1-ol

IUPAC name

2-{benzyl[3-(4-fluorophenyl)-[12]oxazolo[54-d]pyrimidin-4-yl]amino}ethan-1-ol

SMILES

OCCN(Cc1ccccc1)c1c(c(-c(cc2)ccc2F)no2)c2ncn1

InChI

InChI=1S/C20H17FN4O2/c21-16-8-6-15(7-9-16)18-17-19(22-13-23-20(17)27-24-18)25(10-11-26)12-14-4-2-1-3-5-14/h1-9,13,26H,10-12H2

InChI Key

RNPVOTAZYZCMJI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14929249

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

364.38

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

3.449

Distribution Coefficient, logD

3.449

Water Solubility, LogSw

-3.60

Polar Surface Area

61.731

Acid Dissociation Constant (pKa)

15.18

Base Dissociation Constant (pKb)

2.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

E944-0470 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

BRD4 Targeted Library (4534 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Hemic and lymphatic
  • Cardiovascular
  • Metabolic
Agro:
  • Agro
Targets:
  • Others

References: we are preparing a list of scientific research reports with E944-0470 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E944-0470?
Check Price and Availability of E944-0470, 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 E944-0470 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E944-0470
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E944-0470
  • 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 E944-0470 available by request