7773-0100 Screening compound: methyl 7-(4-fluorophenyl)-6,8-dioxo-1-oxa-2,7-diazaspiro[4.4]non-2-ene-3-carboxylate

7773-0100 Screening compound: methyl 7-(4-fluorophenyl)-6,8-dioxo-1-oxa-2,7-diazaspiro[4.4]non-2-ene-3-carboxylate
7773-0100 Screening compound: methyl 7-(4-fluorophenyl)-6,8-dioxo-1-oxa-2,7-diazaspiro[4.4]non-2-ene-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 7773-0100
methyl 7-(4-fluorophenyl)-6,8-dioxo-1-oxa-2,7-diazaspiro[4.4]non-2-ene-3-carboxylate

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

7773-0100

Molecular Formula

C14H11FN2O5 (C14 H11 FN2 O5)

Compound Name

methyl 7-(4-fluorophenyl)-6,8-dioxo-1-oxa-2,7-diazaspiro[4.4]non-2-ene-3-carboxylate

IUPAC name

methyl 7-(4-fluorophenyl)-68-dioxo-1-oxa-27-diazaspiro[4.4]non-2-ene-3-carboxylate

SMILES

COC(C(C1)=NOC1(CC(N1c(cc2)ccc2F)=O)C1=O)=O

InChI

InChI=1S/C14H11FN2O5/c1-21-12(19)10-6-14(22-16-10)7-11(18)17(13(14)20)9-4-2-8(15)3-5-9/h2-5H,6-7H2,1H3/t14-/m0/s1

InChI Key

DPECWIJYEXICQB-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD06602586

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

306.25

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.298

Distribution Coefficient, logD

0.298

Water Solubility, LogSw

-1.41

Polar Surface Area

72.640

Acid Dissociation Constant (pKa)

18.65

Base Dissociation Constant (pKb)

-8.99

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

28.57

7773-0100 in Drug Discovery

Included in Screening Libraries

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

Akt-Targeted Library (14764 compounds)

Anti-HIV1 Library (19540 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Antiviral
  • Infections
  • Immune system
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 7773-0100 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7773-0100?
Check Price and Availability of 7773-0100, 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 7773-0100 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7773-0100
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7773-0100
  • 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 7773-0100 available by request