C498-1329 Screening compound: N-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydroacridin-9-amine

C498-1329 Screening compound: N-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydroacridin-9-amine
C498-1329 Screening compound: N-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydroacridin-9-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound C498-1329
N-(3,4,5-trimethoxyphenyl)-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

C498-1329

Molecular Formula

C22H24N2O3 (C22 H24 N2 O3)

Compound Name

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

IUPAC name

N-(345-trimethoxyphenyl)-1234-tetrahydroacridin-9-amine

SMILES

COc1cc(Nc2c(CCCC3)c3nc3ccccc23)cc(OC)c1OC

InChI

InChI=1S/C22H24N2O3/c1-25-19-12-14(13-20(26-2)22(19)27-3)23-21-15-8-4-6-10-17(15)24-18-11-7-5-9-16(18)21/h4,6,8,10,12-13H,5,7,9,11H2,1-3H3,(H,23,24)

InChI Key

MVECHRPJOUWIRV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14762351

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

364.44

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.255

Distribution Coefficient, logD

1.981

Water Solubility, LogSw

-4.46

Polar Surface Area

40.485

Acid Dissociation Constant (pKa)

17.36

Base Dissociation Constant (pKb)

9.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

C498-1329 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with C498-1329 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C498-1329?
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What is the minimum amount of C498-1329 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C498-1329
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C498-1329
  • 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 C498-1329 available by request