G803-0576 Screening compound: N-{2-[benzyl(methyl)amino]ethyl}-3-(3,5-difluorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine

G803-0576 Screening compound: N-{2-[benzyl(methyl)amino]ethyl}-3-(3,5-difluorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine
G803-0576 Screening compound: N-{2-[benzyl(methyl)amino]ethyl}-3-(3,5-difluorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound G803-0576
N-{2-[benzyl(methyl)amino]ethyl}-3-(3,5-difluorophenyl)-[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

G803-0576

Molecular Formula

C21H19F2N5O (C21 H19 F2 N5 O)

Compound Name

N-{2-[benzyl(methyl)amino]ethyl}-3-(3,5-difluorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine

IUPAC name

N-{2-[benzyl(methyl)amino]ethyl}-3-(35-difluorophenyl)-[12]oxazolo[54-d]pyrimidin-4-amine

SMILES

CN(CCNc1c(c(-c2cc(F)cc(F)c2)no2)c2ncn1)Cc1ccccc1

InChI

InChI=1S/C21H19F2N5O/c1-28(12-14-5-3-2-4-6-14)8-7-24-20-18-19(27-29-21(18)26-13-25-20)15-9-16(22)11-17(23)10-15/h2-6,9-11,13H,7-8,12H2,1H3,(H,24,25,26)

InChI Key

BOTOKEHHJYNNNH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15037192

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.107

Distribution Coefficient, logD

3.385

Water Solubility, LogSw

-4.37

Polar Surface Area

56.959

Acid Dissociation Constant (pKa)

17.27

Base Dissociation Constant (pKb)

8.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

G803-0576 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Antiviral Library (67538 compounds)

MCL1 Targeted Library (12200 compounds)

Targeted Diversity Library (40567 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Antiviral
  • Infections
  • Immune system
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • 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 G803-0576 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G803-0576?
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What is the minimum amount of G803-0576 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G803-0576
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G803-0576
  • 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 G803-0576 available by request