C598-0627 Screening compound: 9-chloro-N-(4-methylcyclohexyl)-5,6,7,8-tetrahydroacridine-3-carboxamide

C598-0627 Screening compound: 9-chloro-N-(4-methylcyclohexyl)-5,6,7,8-tetrahydroacridine-3-carboxamide
C598-0627 Screening compound: 9-chloro-N-(4-methylcyclohexyl)-5,6,7,8-tetrahydroacridine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C598-0627
9-chloro-N-(4-methylcyclohexyl)-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

C598-0627

Molecular Formula

C21H25ClN2O (C21 H25 ClN2 O)

Compound Name

9-chloro-N-(4-methylcyclohexyl)-5,6,7,8-tetrahydroacridine-3-carboxamide

IUPAC name

9-chloro-N-(4-methylcyclohexyl)-5678-tetrahydroacridine-3-carboxamide

SMILES

CC(CC1)CCC1NC(c1ccc2c(Cl)c(CCCC3)c3nc2c1)=O

InChI

InChI=1S/C21H25ClN2O/c1-13-6-9-15(10-7-13)23-21(25)14-8-11-17-19(12-14)24-18-5-3-2-4-16(18)20(17)22/h8,11-13,15H,2-7,9-10H2,1H3,(H,23,25)

InChI Key

PWBZCALOGRSFOF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14774901

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

356.9

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

6.241

Distribution Coefficient, logD

6.199

Water Solubility, LogSw

-6.35

Polar Surface Area

34.129

Acid Dissociation Constant (pKa)

14.10

Base Dissociation Constant (pKb)

6.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.40

C598-0627 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

CNS BBB Library (22607 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Nervous system
  • Cardiovascular
Mechanism of action:
  • Epigenetic
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with C598-0627 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C598-0627?
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What is the minimum amount of C598-0627 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C598-0627
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C598-0627
  • 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 C598-0627 available by request