2722-0030 Screening compound: 4-{[2-(4-ethoxyphenyl)-4-(4-fluorophenyl)-4H-chromen-3-yl]methyl}morpholine

2722-0030 Screening compound: 4-{[2-(4-ethoxyphenyl)-4-(4-fluorophenyl)-4H-chromen-3-yl]methyl}morpholine
2722-0030 Screening compound: 4-{[2-(4-ethoxyphenyl)-4-(4-fluorophenyl)-4H-chromen-3-yl]methyl}morpholine alternative view

Chemical Structure Depiction of ChemDiv screening compound 2722-0030
4-{[2-(4-ethoxyphenyl)-4-(4-fluorophenyl)-4H-chromen-3-yl]methyl}morpholine

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

2722-0030

Molecular Formula

C28H28FNO3 (C28 H28 FNO3)

Compound Name

4-{[2-(4-ethoxyphenyl)-4-(4-fluorophenyl)-4H-chromen-3-yl]methyl}morpholine

IUPAC name

4-{[2-(4-ethoxyphenyl)-4-(4-fluorophenyl)-4H-chromen-3-yl]methyl}morpholine

SMILES

CCOc(cc1)ccc1C1=C(CN2CCOCC2)C(c(cc2)ccc2F)c(cccc2)c2O1

InChI

InChI=1S/C28H28FNO3/c1-2-32-23-13-9-21(10-14-23)28-25(19-30-15-17-31-18-16-30)27(20-7-11-22(29)12-8-20)24-5-3-4-6-26(24)33-28/h3-14,27H,2,15-19H2,1H3/t27-/m0/s1

InChI Key

SDILMVGNWPKUBF-MHZLTWQESA-N

MDL Number (MFCD)

MFCD01179358

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

445.53

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.360

Distribution Coefficient, logD

5.360

Water Solubility, LogSw

-5.58

Polar Surface Area

25.624

Acid Dissociation Constant (pKa)

14.02

Base Dissociation Constant (pKb)

1.87

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

28.60

2722-0030 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 2722-0030 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2722-0030?
Check Price and Availability of 2722-0030, 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 2722-0030 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2722-0030
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2722-0030
  • 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 2722-0030 available by request