E899-0300 Screening compound: N-{4-[(4-ethylpiperazin-1-yl)methyl]phenyl}-3-(4-fluorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine

E899-0300 Screening compound: N-{4-[(4-ethylpiperazin-1-yl)methyl]phenyl}-3-(4-fluorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine
E899-0300 Screening compound: N-{4-[(4-ethylpiperazin-1-yl)methyl]phenyl}-3-(4-fluorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound E899-0300
N-{4-[(4-ethylpiperazin-1-yl)methyl]phenyl}-3-(4-fluorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine

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

E899-0300

Molecular Formula

C24H25FN6O (C24 H25 FN6 O)

Compound Name

N-{4-[(4-ethylpiperazin-1-yl)methyl]phenyl}-3-(4-fluorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine

IUPAC name

N-{4-[(4-ethylpiperazin-1-yl)methyl]phenyl}-3-(4-fluorophenyl)-[12]oxazolo[54-d]pyrimidin-4-amine

SMILES

CCN1CCN(Cc(cc2)ccc2Nc2c(c(-c(cc3)ccc3F)no3)c3ncn2)CC1

InChI

InChI=1S/C24H25FN6O/c1-2-30-11-13-31(14-12-30)15-17-3-9-20(10-4-17)28-23-21-22(18-5-7-19(25)8-6-18)29-32-24(21)27-16-26-23/h3-10,16H,2,11-15H2,1H3,(H,26,27,28)

InChI Key

NFNBDIOOPHIIJW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14926757

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

432.5

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.539

Distribution Coefficient, logD

2.608

Water Solubility, LogSw

-3.80

Polar Surface Area

58.971

Acid Dissociation Constant (pKa)

17.58

Base Dissociation Constant (pKb)

8.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

E899-0300 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anticancer Library (62698 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with E899-0300 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E899-0300?
Check Price and Availability of E899-0300, 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 E899-0300 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E899-0300
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E899-0300
  • 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 E899-0300 available by request