F217-0436 Screening compound: 4-{[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]methyl}-N-(4-methoxy-3-methylphenyl)benzamide

F217-0436 Screening compound: 4-{[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]methyl}-N-(4-methoxy-3-methylphenyl)benzamide
F217-0436 Screening compound: 4-{[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]methyl}-N-(4-methoxy-3-methylphenyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F217-0436
4-{[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]methyl}-N-(4-methoxy-3-methylphenyl)benzamide

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

F217-0436

Molecular Formula

C26H27NO4 (C26 H27 NO4)

Compound Name

4-{[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]methyl}-N-(4-methoxy-3-methylphenyl)benzamide

IUPAC name

4-{[(22-dimethyl-23-dihydro-1-benzofuran-7-yl)oxy]methyl}-N-(4-methoxy-3-methylphenyl)benzamide

SMILES

CC(C)(Cc1ccc2)Oc1c2OCc(cc1)ccc1C(Nc(cc1)cc(C)c1OC)=O

InChI

InChI=1S/C26H27NO4/c1-17-14-21(12-13-22(17)29-4)27-25(28)19-10-8-18(9-11-19)16-30-23-7-5-6-20-15-26(2,3)31-24(20)23/h5-14H,15-16H2,1-4H3,(H,27,28)

InChI Key

FVTYGPZNEVZHBC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09240946

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

417.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.555

Distribution Coefficient, logD

5.555

Water Solubility, LogSw

-5.59

Polar Surface Area

44.657

Acid Dissociation Constant (pKa)

10.97

Base Dissociation Constant (pKb)

-1.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.90

F217-0436 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F217-0436 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F217-0436?
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What is the minimum amount of F217-0436 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F217-0436
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F217-0436
  • 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 F217-0436 available by request