8018-7994 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(5-fluoro-1H-indol-3-yl)-2-oxoacetamide

8018-7994 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(5-fluoro-1H-indol-3-yl)-2-oxoacetamide
8018-7994 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(5-fluoro-1H-indol-3-yl)-2-oxoacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-7994
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(5-fluoro-1H-indol-3-yl)-2-oxoacetamide

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

8018-7994

Molecular Formula

C18H13FN2O4 (C18 H13 FN2 O4)

Compound Name

N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(5-fluoro-1H-indol-3-yl)-2-oxoacetamide

IUPAC name

N-(23-dihydro-14-benzodioxin-6-yl)-2-(5-fluoro-1H-indol-3-yl)-2-oxoacetamide

SMILES

O=C(C(Nc(cc1)cc2c1OCCO2)=O)c1c[nH]c(cc2)c1cc2F

InChI

InChI=1S/C18H13FN2O4/c19-10-1-3-14-12(7-10)13(9-20-14)17(22)18(23)21-11-2-4-15-16(8-11)25-6-5-24-15/h1-4,7-9,20H,5-6H2,(H,21,23)

InChI Key

NFYDTHIGRMTRLP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08532384

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

340.31

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.281

Distribution Coefficient, logD

2.274

Water Solubility, LogSw

-3.17

Polar Surface Area

62.762

Acid Dissociation Constant (pKa)

9.16

Base Dissociation Constant (pKb)

2.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

8018-7994 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiviral Library (67538 compounds)

Cardiovascular Library (22201 compounds)

Covalent Inhibitors Library (7986 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cardiovascular
Mechanism of action:
  • Epigenetic
Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with 8018-7994 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-7994?
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What is the minimum amount of 8018-7994 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-7994
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-7994
  • 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 8018-7994 available by request