E899-0188 Screening compound: N-{3-[butyl(ethyl)amino]propyl}-3-(4-fluorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine

E899-0188 Screening compound: N-{3-[butyl(ethyl)amino]propyl}-3-(4-fluorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine
E899-0188 Screening compound: N-{3-[butyl(ethyl)amino]propyl}-3-(4-fluorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound E899-0188
N-{3-[butyl(ethyl)amino]propyl}-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

E899-0188

Molecular Formula

C20H26FN5O (C20 H26 FN5 O)

Compound Name

N-{3-[butyl(ethyl)amino]propyl}-3-(4-fluorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine

IUPAC name

N-{3-[butyl(ethyl)amino]propyl}-3-(4-fluorophenyl)-[12]oxazolo[54-d]pyrimidin-4-amine

SMILES

CCCCN(CC)CCCNc1c(c(-c(cc2)ccc2F)no2)c2ncn1

InChI

InChI=1S/C20H26FN5O/c1-3-5-12-26(4-2)13-6-11-22-19-17-18(15-7-9-16(21)10-8-15)25-27-20(17)24-14-23-19/h7-10,14H,3-6,11-13H2,1-2H3,(H,22,23,24)

InChI Key

VBNAMPNBECVFSL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14926717

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

371.46

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.092

Distribution Coefficient, logD

1.879

Water Solubility, LogSw

-4.13

Polar Surface Area

56.801

Acid Dissociation Constant (pKa)

18.99

Base Dissociation Constant (pKb)

9.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.00

E899-0188 in Drug Discovery

Included in Screening Libraries

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with E899-0188 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E899-0188?
Check Price and Availability of E899-0188, 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 E899-0188 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E899-0188
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E899-0188
  • 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 E899-0188 available by request