F217-0323 Screening compound: 1-(4-{[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]methyl}benzoyl)-1,2,3,4-tetrahydroquinoline

F217-0323 Screening compound: 1-(4-{[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]methyl}benzoyl)-1,2,3,4-tetrahydroquinoline
F217-0323 Screening compound: 1-(4-{[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]methyl}benzoyl)-1,2,3,4-tetrahydroquinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound F217-0323
1-(4-{[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]methyl}benzoyl)-1,2,3,4-tetrahydroquinoline

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

F217-0323

Molecular Formula

C27H27NO3 (C27 H27 NO3)

Compound Name

1-(4-{[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]methyl}benzoyl)-1,2,3,4-tetrahydroquinoline

IUPAC name

1-(4-{[(22-dimethyl-23-dihydro-1-benzofuran-7-yl)oxy]methyl}benzoyl)-1234-tetrahydroquinoline

SMILES

CC(C)(Cc1ccc2)Oc1c2OCc(cc1)ccc1C(N(CCC1)c2c1cccc2)=O

InChI

InChI=1S/C27H27NO3/c1-27(2)17-22-8-5-11-24(25(22)31-27)30-18-19-12-14-21(15-13-19)26(29)28-16-6-9-20-7-3-4-10-23(20)28/h3-5,7-8,10-15H,6,9,16-18H2,1-2H3

InChI Key

HKPLDAVOLQQTEU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09240880

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.52

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.627

Distribution Coefficient, logD

5.627

Water Solubility, LogSw

-5.42

Polar Surface Area

29.249

Acid Dissociation Constant (pKa)

26.00

Base Dissociation Constant (pKb)

-2.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.60

F217-0323 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with F217-0323 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F217-0323?
Check Price and Availability of F217-0323, 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 F217-0323 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F217-0323
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F217-0323
  • 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 F217-0323 available by request