C047-1103 Screening compound: 9-(4-chlorophenyl)-3,3,6,6-tetramethyl-10-pentyl-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione

C047-1103 Screening compound: 9-(4-chlorophenyl)-3,3,6,6-tetramethyl-10-pentyl-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione
C047-1103 Screening compound: 9-(4-chlorophenyl)-3,3,6,6-tetramethyl-10-pentyl-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound C047-1103
9-(4-chlorophenyl)-3,3,6,6-tetramethyl-10-pentyl-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

C047-1103

Molecular Formula

C28H36ClNO2 (C28 H36 ClNO2)

Compound Name

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

IUPAC name

9-(4-chlorophenyl)-3366-tetramethyl-10-pentyl-12345678910-decahydroacridine-18-dione

SMILES

CCCCCN(C(CC(C)(C)C1)=C(C2c(cc3)ccc3Cl)C1=O)C(CC(C)(C)C1)=C2C1=O

InChI

InChI=1S/C28H36ClNO2/c1-6-7-8-13-30-20-14-27(2,3)16-22(31)25(20)24(18-9-11-19(29)12-10-18)26-21(30)15-28(4,5)17-23(26)32/h9-12,24H,6-8,13-17H2,1-5H3

InChI Key

WPTOULAYUPWJGA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14713959

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

454.05

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.588

Distribution Coefficient, logD

6.588

Water Solubility, LogSw

-6.55

Polar Surface Area

28.964

Acid Dissociation Constant (pKa)

25.12

Base Dissociation Constant (pKb)

-3.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

57.10

References: we are preparing a list of scientific research reports with C047-1103 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C047-1103?
Check Price and Availability of C047-1103, 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 C047-1103 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C047-1103
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C047-1103
  • 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 C047-1103 available by request