4984-5615 Screening compound: 9-(3-bromo-4,5-diethoxyphenyl)-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione

4984-5615 Screening compound: 9-(3-bromo-4,5-diethoxyphenyl)-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione
4984-5615 Screening compound: 9-(3-bromo-4,5-diethoxyphenyl)-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 4984-5615
9-(3-bromo-4,5-diethoxyphenyl)-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

4984-5615

Molecular Formula

C23H26BrNO4 (C23 H26 BrNO4)

Compound Name

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

IUPAC name

9-(3-bromo-45-diethoxyphenyl)-12345678910-decahydroacridine-18-dione

SMILES

CCOc1cc(C2C(C(CCC3)=O)=C3NC(CCC3)=C2C3=O)cc(Br)c1OCC

InChI

InChI=1S/C23H26BrNO4/c1-3-28-19-12-13(11-14(24)23(19)29-4-2)20-21-15(7-5-9-17(21)26)25-16-8-6-10-18(27)22(16)20/h11-12,20,25H,3-10H2,1-2H3

InChI Key

OFVYOFKUGVOSRO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04084286

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

460.37

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

4.127

Distribution Coefficient, logD

0.464

Water Solubility, LogSw

-4.19

Polar Surface Area

51.996

Acid Dissociation Constant (pKa)

3.74

Base Dissociation Constant (pKb)

-3.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.80

4984-5615 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 4984-5615 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4984-5615?
Check Price and Availability of 4984-5615, 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 4984-5615 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4984-5615
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4984-5615
  • 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 4984-5615 available by request