E939-0337 Screening compound: 3-(4-chlorophenyl)-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-[1,2]oxazolo[5,4-d]pyrimidin-4-amine

E939-0337 Screening compound: 3-(4-chlorophenyl)-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-[1,2]oxazolo[5,4-d]pyrimidin-4-amine
E939-0337 Screening compound: 3-(4-chlorophenyl)-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-[1,2]oxazolo[5,4-d]pyrimidin-4-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound E939-0337
3-(4-chlorophenyl)-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-[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

E939-0337

Molecular Formula

C18H16ClN5O2 (C18 H16 ClN5 O2)

Compound Name

3-(4-chlorophenyl)-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-[1,2]oxazolo[5,4-d]pyrimidin-4-amine

IUPAC name

3-(4-chlorophenyl)-N-[2-(35-dimethyl-12-oxazol-4-yl)ethyl]-[12]oxazolo[54-d]pyrimidin-4-amine

SMILES

Cc1noc(C)c1CCNc1c(c(-c(cc2)ccc2Cl)no2)c2ncn1

InChI

InChI=1S/C18H16ClN5O2/c1-10-14(11(2)25-23-10)7-8-20-17-15-16(12-3-5-13(19)6-4-12)24-26-18(15)22-9-21-17/h3-6,9H,7-8H2,1-2H3,(H,20,21,22)

InChI Key

TUYMZEJMWFWFOP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14928794

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

369.81

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.663

Distribution Coefficient, logD

3.663

Water Solubility, LogSw

-4.23

Polar Surface Area

74.903

Acid Dissociation Constant (pKa)

18.26

Base Dissociation Constant (pKb)

2.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

E939-0337 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Anti-Inflammatory Library (24602 compounds)

MCL1 Targeted Library (12200 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • 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 E939-0337 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E939-0337?
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What is the minimum amount of E939-0337 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E939-0337
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E939-0337
  • 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 E939-0337 available by request