E910-0032 Screening compound: 5-[3-(azepan-1-yl)-3-oxopropyl]-3-(4-fluorophenyl)-4H,5H-[1,2]oxazolo[5,4-d]pyrimidin-4-one

E910-0032 Screening compound: 5-[3-(azepan-1-yl)-3-oxopropyl]-3-(4-fluorophenyl)-4H,5H-[1,2]oxazolo[5,4-d]pyrimidin-4-one
E910-0032 Screening compound: 5-[3-(azepan-1-yl)-3-oxopropyl]-3-(4-fluorophenyl)-4H,5H-[1,2]oxazolo[5,4-d]pyrimidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound E910-0032
5-[3-(azepan-1-yl)-3-oxopropyl]-3-(4-fluorophenyl)-4H,5H-[1,2]oxazolo[5,4-d]pyrimidin-4-one

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

E910-0032

Molecular Formula

C20H21FN4O3 (C20 H21 FN4 O3)

Compound Name

5-[3-(azepan-1-yl)-3-oxopropyl]-3-(4-fluorophenyl)-4H,5H-[1,2]oxazolo[5,4-d]pyrimidin-4-one

IUPAC name

5-[3-(azepan-1-yl)-3-oxopropyl]-3-(4-fluorophenyl)-4H5H-[12]oxazolo[54-d]pyrimidin-4-one

SMILES

O=C(CCN(C=Nc1c2c(-c(cc3)ccc3F)no1)C2=O)N1CCCCCC1

InChI

InChI=1S/C20H21FN4O3/c21-15-7-5-14(6-8-15)18-17-19(28-23-18)22-13-25(20(17)27)12-9-16(26)24-10-3-1-2-4-11-24/h5-8,13H,1-4,9-12H2

InChI Key

MTLWXMYKSUMAPE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14927102

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

384.41

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.048

Distribution Coefficient, logD

2.048

Water Solubility, LogSw

-2.29

Polar Surface Area

64.404

Acid Dissociation Constant (pKa)

23.94

Base Dissociation Constant (pKb)

3.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

E910-0032 in Drug Discovery

Included in Screening Libraries

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with E910-0032 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E910-0032?
Check Price and Availability of E910-0032, 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 E910-0032 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E910-0032
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E910-0032
  • 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 E910-0032 available by request