8011-7997 Screening compound: 9-[4-(benzyloxy)-3-ethoxyphenyl]-3,3,6,6,10-pentamethyl-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione

8011-7997 Screening compound: 9-[4-(benzyloxy)-3-ethoxyphenyl]-3,3,6,6,10-pentamethyl-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione
8011-7997 Screening compound: 9-[4-(benzyloxy)-3-ethoxyphenyl]-3,3,6,6,10-pentamethyl-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 8011-7997
9-[4-(benzyloxy)-3-ethoxyphenyl]-3,3,6,6,10-pentamethyl-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

8011-7997

Molecular Formula

C33H39NO4 (C33 H39 NO4)

Compound Name

9-[4-(benzyloxy)-3-ethoxyphenyl]-3,3,6,6,10-pentamethyl-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione

IUPAC name

9-[4-(benzyloxy)-3-ethoxyphenyl]-336610-pentamethyl-12345678910-decahydroacridine-18-dione

SMILES

CCOc(cc(C1C(C(CC(C)(C)C2)=O)=C2N(C)C(CC(C)(C)C2)=C1C2=O)cc1)c1OCc1ccccc1

InChI

InChI=1S/C33H39NO4/c1-7-37-28-15-22(13-14-27(28)38-20-21-11-9-8-10-12-21)29-30-23(16-32(2,3)18-25(30)35)34(6)24-17-33(4,5)19-26(36)31(24)29/h8-15,29H,7,16-20H2,1-6H3

InChI Key

AUPNYAKECCZZLX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02852968

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

513.68

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.185

Distribution Coefficient, logD

5.185

Water Solubility, LogSw

-5.18

Polar Surface Area

43.276

Acid Dissociation Constant (pKa)

25.12

Base Dissociation Constant (pKb)

-3.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.50

References: we are preparing a list of scientific research reports with 8011-7997 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8011-7997?
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What is the minimum amount of 8011-7997 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8011-7997
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8011-7997
  • 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 8011-7997 available by request