4984-5589 Screening compound: 9-{4-[(2-fluorophenyl)methoxy]-3-methoxyphenyl}-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione

4984-5589 Screening compound: 9-{4-[(2-fluorophenyl)methoxy]-3-methoxyphenyl}-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione
4984-5589 Screening compound: 9-{4-[(2-fluorophenyl)methoxy]-3-methoxyphenyl}-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 4984-5589
9-{4-[(2-fluorophenyl)methoxy]-3-methoxyphenyl}-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione

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

4984-5589

Molecular Formula

C27H26FNO4 (C27 H26 FNO4)

Compound Name

9-{4-[(2-fluorophenyl)methoxy]-3-methoxyphenyl}-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione

IUPAC name

9-{4-[(2-fluorophenyl)methoxy]-3-methoxyphenyl}-12345678910-decahydroacridine-18-dione

SMILES

COc(cc(C1C(C(CCC2)=O)=C2NC(CCC2)=C1C2=O)cc1)c1OCc(cccc1)c1F

InChI

InChI=1S/C27H26FNO4/c1-32-24-14-16(12-13-23(24)33-15-17-6-2-3-7-18(17)28)25-26-19(8-4-10-21(26)30)29-20-9-5-11-22(31)27(20)25/h2-3,6-7,12-14,25,29H,4-5,8-11,15H2,1H3

InChI Key

FCZUYRRMNXRNNS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04084284

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

447.51

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.095

Distribution Coefficient, logD

0.431

Water Solubility, LogSw

-4.36

Polar Surface Area

52.433

Acid Dissociation Constant (pKa)

3.74

Base Dissociation Constant (pKb)

-3.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with 4984-5589 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4984-5589?
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What is the minimum amount of 4984-5589 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4984-5589
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4984-5589
  • 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 4984-5589 available by request