4984-5159 Screening compound: 9-(4-ethoxyphenyl)-3,3,6,6-tetramethyl-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione

4984-5159 Screening compound: 9-(4-ethoxyphenyl)-3,3,6,6-tetramethyl-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione
4984-5159 Screening compound: 9-(4-ethoxyphenyl)-3,3,6,6-tetramethyl-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 4984-5159
9-(4-ethoxyphenyl)-3,3,6,6-tetramethyl-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

4984-5159

Molecular Formula

C25H31NO3 (C25 H31 NO3)

Compound Name

9-(4-ethoxyphenyl)-3,3,6,6-tetramethyl-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione

IUPAC name

9-(4-ethoxyphenyl)-3366-tetramethyl-12345678910-decahydroacridine-18-dione

SMILES

CCOc1ccc(C2C(C(CC(C)(C)C3)=O)=C3NC(CC(C)(C)C3)=C2C3=O)cc1

InChI

InChI=1S/C25H31NO3/c1-6-29-16-9-7-15(8-10-16)21-22-17(11-24(2,3)13-19(22)27)26-18-12-25(4,5)14-20(28)23(18)21/h7-10,21,26H,6,11-14H2,1-5H3

InChI Key

DTTGOTRBJWQXNA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00755107

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.53

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.404

Distribution Coefficient, logD

-0.042

Water Solubility, LogSw

-4.37

Polar Surface Area

44.612

Acid Dissociation Constant (pKa)

2.95

Base Dissociation Constant (pKb)

-3.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.00

References: we are preparing a list of scientific research reports with 4984-5159 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4984-5159?
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What is the minimum amount of 4984-5159 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4984-5159
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4984-5159
  • 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 4984-5159 available by request