3647-2403 Screening compound: 9-(benzylamino)-3,3-dimethyl-1,2,3,4-tetrahydroacridin-1-one

3647-2403 Screening compound: 9-(benzylamino)-3,3-dimethyl-1,2,3,4-tetrahydroacridin-1-one
3647-2403 Screening compound: 9-(benzylamino)-3,3-dimethyl-1,2,3,4-tetrahydroacridin-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3647-2403
9-(benzylamino)-3,3-dimethyl-1,2,3,4-tetrahydroacridin-1-one

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

3647-2403

Molecular Formula

C22H22N2O (C22 H22 N2 O)

Compound Name

9-(benzylamino)-3,3-dimethyl-1,2,3,4-tetrahydroacridin-1-one

IUPAC name

9-(benzylamino)-33-dimethyl-1234-tetrahydroacridin-1-one

SMILES

CC(C)(Cc1nc2ccccc2c(NCc2ccccc2)c11)CC1=O

InChI

InChI=1S/C22H22N2O/c1-22(2)12-18-20(19(25)13-22)21(16-10-6-7-11-17(16)24-18)23-14-15-8-4-3-5-9-15/h3-11H,12-14H2,1-2H3,(H,23,24)

InChI Key

UFEQPHYISGZSKN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00690560

Chemical and Physical Properties

Saltdata

HOOCCOOH

Molecular Weight

330.43

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.936

Distribution Coefficient, logD

3.935

Water Solubility, LogSw

-4.38

Polar Surface Area

32.077

Acid Dissociation Constant (pKa)

14.60

Base Dissociation Constant (pKb)

4.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

3647-2403 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Agro:
  • Agro
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 3647-2403 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3647-2403?
Check Price and Availability of 3647-2403, 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 3647-2403 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3647-2403
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3647-2403
  • 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 3647-2403 available by request