C066-3005 Screening compound: N-(3,5-dimethylphenyl)-1,2,3,4-tetrahydroacridin-9-amine

C066-3005 Screening compound: N-(3,5-dimethylphenyl)-1,2,3,4-tetrahydroacridin-9-amine
C066-3005 Screening compound: N-(3,5-dimethylphenyl)-1,2,3,4-tetrahydroacridin-9-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound C066-3005
N-(3,5-dimethylphenyl)-1,2,3,4-tetrahydroacridin-9-amine

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

C066-3005

Molecular Formula

C21H22N2 (C21 H22 N2)

Compound Name

N-(3,5-dimethylphenyl)-1,2,3,4-tetrahydroacridin-9-amine

IUPAC name

N-(35-dimethylphenyl)-1234-tetrahydroacridin-9-amine

SMILES

Cc1cc(Nc2c(CCCC3)c3nc3ccccc23)cc(C)c1

InChI

InChI=1S/C21H22N2/c1-14-11-15(2)13-16(12-14)22-21-17-7-3-5-9-19(17)23-20-10-6-4-8-18(20)21/h3,5,7,9,11-13H,4,6,8,10H2,1-2H3,(H,22,23)

InChI Key

UYOMHXGTHRLATO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14715482

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

302.42

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.568

Distribution Coefficient, logD

3.293

Water Solubility, LogSw

-5.76

Polar Surface Area

17.507

Acid Dissociation Constant (pKa)

20.01

Base Dissociation Constant (pKb)

9.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

C066-3005 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

GABA Library (7115 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Eye
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C066-3005 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C066-3005?
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What is the minimum amount of C066-3005 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C066-3005
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C066-3005
  • 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 C066-3005 available by request