D330-1252 Screening compound: 1-ethyl-3-[(5-fluoro-3-methyl-1-benzofuran-2-yl)methyl]-2,3-dihydro-1H-indol-2-one

D330-1252 Screening compound: 1-ethyl-3-[(5-fluoro-3-methyl-1-benzofuran-2-yl)methyl]-2,3-dihydro-1H-indol-2-one
D330-1252 Screening compound: 1-ethyl-3-[(5-fluoro-3-methyl-1-benzofuran-2-yl)methyl]-2,3-dihydro-1H-indol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D330-1252
1-ethyl-3-[(5-fluoro-3-methyl-1-benzofuran-2-yl)methyl]-2,3-dihydro-1H-indol-2-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

D330-1252

Molecular Formula

C20H18FNO2 (C20 H18 FNO2)

Compound Name

1-ethyl-3-[(5-fluoro-3-methyl-1-benzofuran-2-yl)methyl]-2,3-dihydro-1H-indol-2-one

IUPAC name

1-ethyl-3-[(5-fluoro-3-methyl-1-benzofuran-2-yl)methyl]-23-dihydro-1H-indol-2-one

SMILES

CCN(C(C1Cc2c(C)c(cc(cc3)F)c3o2)=O)c2c1cccc2

InChI

InChI=1S/C20H18FNO2/c1-3-22-17-7-5-4-6-14(17)16(20(22)23)11-19-12(2)15-10-13(21)8-9-18(15)24-19/h4-10,16H,3,11H2,1-2H3/t16-/m0/s1

InChI Key

NESQVUSTSDAFDA-INIZCTEOSA-N

MDL Number (MFCD)

MFCD13370002

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

323.37

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.370

Distribution Coefficient, logD

4.370

Water Solubility, LogSw

-4.31

Polar Surface Area

23.128

Acid Dissociation Constant (pKa)

11.09

Base Dissociation Constant (pKb)

-2.14

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

D330-1252 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Cardiovascular Library (22201 compounds)

GABA Library (7115 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cardiovascular
  • Eye
Agro:
  • Agro
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with D330-1252 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D330-1252?
Check Price and Availability of D330-1252, 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 D330-1252 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D330-1252
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D330-1252
  • 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 D330-1252 available by request