C598-0409 Screening compound: N-butyl-9-chloro-5,6,7,8-tetrahydroacridine-3-carboxamide

C598-0409 Screening compound: N-butyl-9-chloro-5,6,7,8-tetrahydroacridine-3-carboxamide
C598-0409 Screening compound: N-butyl-9-chloro-5,6,7,8-tetrahydroacridine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C598-0409
N-butyl-9-chloro-5,6,7,8-tetrahydroacridine-3-carboxamide

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

C598-0409

Molecular Formula

C18H21ClN2O (C18 H21 ClN2 O)

Compound Name

N-butyl-9-chloro-5,6,7,8-tetrahydroacridine-3-carboxamide

IUPAC name

N-butyl-9-chloro-5678-tetrahydroacridine-3-carboxamide

SMILES

CCCCNC(c1ccc2c(Cl)c(CCCC3)c3nc2c1)=O

InChI

InChI=1S/C18H21ClN2O/c1-2-3-10-20-18(22)12-8-9-14-16(11-12)21-15-7-5-4-6-13(15)17(14)19/h8-9,11H,2-7,10H2,1H3,(H,20,22)

InChI Key

JSGQYUOKNYQUGR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14774739

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

316.83

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.913

Distribution Coefficient, logD

4.870

Water Solubility, LogSw

-5.10

Polar Surface Area

34.517

Acid Dissociation Constant (pKa)

13.48

Base Dissociation Constant (pKb)

6.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.40

C598-0409 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Anti-infective Library (19449 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Immune system
  • animal
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C598-0409 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C598-0409?
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What is the minimum amount of C598-0409 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C598-0409
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C598-0409
  • 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 C598-0409 available by request